PEAK 198 (3.56 ppm) DETAILS

GENERAL INFORMATION

PEAK DETECTION

WINDOW ALIGNMENT

INTENSITY DISTRIBUTION

CORRELATION ANALYSIS

CORRCOEF	ID_PEAK	INFO	PPM	ID_WINDOW		QC_SC	QC_IvsA	QC_IP		G_95	G_90	G_85	G_80		INFO
0.73	p3	+	8.72	61 (8.753-8.675)		0.98	0.99	0.1		G95_26 (1)	G90_19 (1)	G85_1 (69)	G80_1 (106)		+
0.78	p18	+	7.871	82 (7.932-7.854)		0.97	0.97	0.35		G95_6 (5)	G90_4 (16)	G85_1 (69)	G80_1 (106)		+
0.78	p19	+	7.884	83 (7.893-7.815)		0.97	0.95	0.4		G95_6 (5)	G90_4 (16)	G85_1 (69)	G80_1 (106)		+
0.76	p30	+	7.205	100 (7.228-7.15)		0.98	0.93	0.35		G95_1 (27)	G90_2 (29)	G85_1 (69)	G80_1 (106)		+
0.76	p31	+	7.191	100 (7.228-7.15)		0.98	0.93	0.4		G95_1 (27)	G90_2 (29)	G85_1 (69)	G80_1 (106)		+
0.81	p32	+	7.06	103 (7.11-7.032)		0.91	0.93	0.15		G95_30 (1)	G90_23 (1)	G85_1 (69)	G80_1 (106)		+
0.75	p34	+	6.909	107 (6.954-6.876)		0.98	0.95	0.3		G95_1 (27)	G90_2 (29)	G85_1 (69)	G80_1 (106)		+
0.75	p35	+	6.895	107 (6.954-6.876)		0.98	0.93	0.3		G95_1 (27)	G90_2 (29)	G85_1 (69)	G80_1 (106)		+
0.75	p48	+	5.923	132 (5.976-5.898)		0.97	0.97	0.25		G95_6 (5)	G90_4 (16)	G85_1 (69)	G80_1 (106)		+
0.78	p49	+	5.916	132 (5.976-5.898)		0.94	0.94	0.15		G95_6 (5)	G90_4 (16)	G85_1 (69)	G80_1 (106)		+
0.76	p53	+	5.908	133 (5.937-5.859)		0.93	0.95	0.2		G95_6 (5)	G90_4 (16)	G85_1 (69)	G80_1 (106)		+
0.75	p55	+	5.894	134 (5.898-5.82)		0.95	0.94	0.2		G95_6 (5)	G90_4 (16)	G85_1 (69)	G80_1 (106)		+
0.79	p89	+	4.256	175 (4.294-4.216)		0.59	0.5	0.1		G95_39 (1)	G90_2 (29)	G85_1 (69)	G80_1 (106)		+
0.77	p90	+	4.231	175 (4.294-4.216)		0.89	0.79	0.3		G95_6 (5)	G90_4 (16)	G85_1 (69)	G80_1 (106)		+
0.88	p93	+	4.147	178 (4.177-4.099)		0.93	0.88	0.25		G95_40 (1)	G90_31 (1)	G85_1 (69)	G80_1 (106)		+
0.84	p240	+	3.349	198 (3.395-3.317)		0.88	0.76	0.1		G95_80 (0)	G90_57 (0)	G85_1 (69)	G80_1 (106)		+
0.72	p241	+	3.331	198 (3.395-3.317)		0.94	0.94	0.45		G95_3 (15)	G90_3 (19)	G85_3 (19)	G80_1 (106)		+
0.79	p265	+	3.183	202 (3.238-3.16)		0.89	0.89	0.35		G95_88 (0)	G90_64 (0)	G85_1 (69)	G80_1 (106)		+
0.79	p276	+	3.029	206 (3.082-3.004)		0.98	0.88	0.6		G95_1 (27)	G90_2 (29)	G85_1 (69)	G80_1 (106)		+
0.78	p277	+	3.016	206 (3.082-3.004)		0.96	0.81	0.55		G95_1 (27)	G90_2 (29)	G85_1 (69)	G80_1 (106)		+
0.72	p300	+	2.801	212 (2.847-2.769)		0.86	0.74	0.25		G95_19 (2)	G90_10 (3)	G85_1 (69)	G80_1 (106)		+
0.75	p303	+	2.68	216 (2.691-2.613)		0.86	0.86	0.2		G95_19 (2)	G90_10 (3)	G85_1 (69)	G80_1 (106)		+
0.86	p304	+	2.648	216 (2.691-2.613)		0.95	0.9	0.5		G95_20 (2)	G90_2 (29)	G85_1 (69)	G80_1 (106)		+
0.86	p305	+	2.635	216 (2.691-2.613)		0.94	0.83	0.3		G95_20 (2)	G90_2 (29)	G85_1 (69)	G80_1 (106)		+
0.71	p322	+	2.475	221 (2.495-2.417)		0.94	0.86	0.5		G95_10 (3)	G90_5 (8)	G85_1 (69)	G80_1 (106)		+
0.75	p325	+	2.44	221 (2.495-2.417)		0.96	0.89	0.6		G95_10 (3)	G90_5 (8)	G85_1 (69)	G80_1 (106)		+
0.74	p329	+	2.427	222 (2.456-2.378)		0.89	0.87	0.2		G95_95 (0)	G90_68 (0)	G85_1 (69)	G80_1 (106)		+
0.82	p332	+	2.373	223 (2.417-2.339)		0.81	0.88	0.25		G95_21 (2)	G90_11 (2)	G85_1 (69)	G80_1 (106)		+
0.75	p333	+	2.367	223 (2.417-2.339)		0.76	0.83	0.05		G95_97 (0)	G90_11 (2)	G85_1 (69)	G80_1 (106)		+
0.88	p334	+	2.36	223 (2.417-2.339)		0.9	0.94	0.55		G95_98 (0)	G90_5 (8)	G85_1 (69)	G80_1 (106)		+
0.75	p339	+	2.347	224 (2.378-2.3)		0.73	0.86	0.15		G95_21 (2)	G90_11 (2)	G85_1 (69)	G80_1 (106)		+
0.79	p340	+	2.342	224 (2.378-2.3)		0.88	0.81	0.15		G95_99 (0)	G90_70 (0)	G85_1 (69)	G80_1 (106)		+
0.81	p348	+	2.132	229 (2.182-2.104)		0.92	0.93	0.65		G95_22 (2)	G90_5 (8)	G85_1 (69)	G80_1 (106)		+
0.82	p349	+	2.12	229 (2.182-2.104)		0.85	0.85	0.5		G95_22 (2)	G90_5 (8)	G85_1 (69)	G80_1 (106)		+
0.83	p353	+	2.107	230 (2.143-2.065)		0.82	0.88	0.2		G95_102 (0)	G90_5 (8)	G85_1 (69)	G80_1 (106)		+
0.83	p358	+	2.065	231 (2.104-2.026)		0.81	0.7	0.3		G95_105 (0)	G90_74 (0)	G85_1 (69)	G80_1 (106)		+
0.75	p363	+	1.754	239 (1.791-1.713)		0.91	0.72	0.3		G95_1 (27)	G90_2 (29)	G85_1 (69)	G80_1 (106)		+
0.78	p366	+	1.742	240 (1.752-1.674)		0.92	0.77	0.3		G95_1 (27)	G90_2 (29)	G85_1 (69)	G80_1 (106)		+
0.77	p367	+	1.728	240 (1.752-1.674)		0.95	0.8	0.4		G95_1 (27)	G90_2 (29)	G85_1 (69)	G80_1 (106)		+
0.78	p368	+	1.716	240 (1.752-1.674)		0.95	0.8	0.5		G95_1 (27)	G90_2 (29)	G85_1 (69)	G80_1 (106)		+
0.72	p370	+	1.705	241 (1.713-1.635)		0.94	0.72	0.35		G95_1 (27)	G90_2 (29)	G85_1 (69)	G80_1 (106)		+
0.79	p371	+	1.489	245 (1.556-1.478)		0.98	0.97	0.9		G95_23 (2)	G90_16 (2)	G85_14 (1)	G80_1 (106)		+
0.77	p373	+	1.477	246 (1.517-1.439)		0.98	0.97	0.9		G95_23 (2)	G90_16 (2)	G85_14 (1)	G80_1 (106)		+
0.78	p384	+	1.053	257 (1.087-1.009)		0.96	0.83	0.7		G95_1 (27)	G90_2 (29)	G85_1 (69)	G80_1 (106)		+
0.78	p385	+	1.041	257 (1.087-1.009)		0.96	0.82	0.7		G95_1 (27)	G90_2 (29)	G85_1 (69)	G80_1 (106)		+
0.76	p386	+	1.022	257 (1.087-1.009)		0.97	0.67	0.55		G95_1 (27)	G90_2 (29)	G85_1 (69)	G80_1 (106)		+
0.74	p389	+	1.01	258 (1.048-0.97)		0.96	0.69	0.5		G95_1 (27)	G90_2 (29)	G85_1 (69)	G80_1 (106)		+
0.74	p392	+	0.978	258 (1.048-0.97)		0.98	0.83	0.75		G95_1 (27)	G90_2 (29)	G85_1 (69)	G80_1 (106)		+
0.74	p393	+	1.0	259 (1.009-0.931)		0.95	0.78	0.7		G95_1 (27)	G90_2 (29)	G85_1 (69)	G80_1 (106)		+
0.71	p394	+	0.989	259 (1.009-0.931)		0.93	0.74	0.7		G95_1 (27)	G90_2 (29)	G85_1 (69)	G80_1 (106)		+
0.73	p396	+	0.966	259 (1.009-0.931)		0.98	0.89	0.85		G95_1 (27)	G90_2 (29)	G85_1 (69)	G80_1 (106)		+
0.73	p397	+	0.956	259 (1.009-0.931)		0.98	0.82	0.75		G95_1 (27)	G90_2 (29)	G85_1 (69)	G80_1 (106)		+
0.73	p398	+	0.945	259 (1.009-0.931)		0.96	0.65	0.55		G95_1 (27)	G90_2 (29)	G85_1 (69)	G80_1 (106)		+

IDENTIFICATION ANALYSIS

METABOLITE	TYPE		IC:MATCHING	IC:TOTAL	EC:MATCHING	EC:TOTAL	OTHERS		X	Y	Z		SCORE	FIG
Choline-7.0 (c:2/p:1)	M		1	3	1	3	0		0.36	0.06	1.0		0.47
glucose-7.0 (c:4/p:1)	M		1	14	1	5	0		-0.04	0.25	1.0		0.4
glucose-7.0 (c:4/p:2)	M		1	14	1	5	0		-0.06	0.25	1.0		0.4
glucose-7.0 (c:4/p:3)	M		1	14	1	5	0		-0.11	0.25	1.0		0.38
glycerol-7.0 (c:3/p:1)	M		1	4	1	3	0		0.52	0.43	1.0		0.65
glycerol-7.0 (c:3/p:2)	M		1	4	1	3	0		0.39	0.43	1.0		0.61
glycerol-7.0 (c:3/p:3)	M		1	4	1	3	0		0.04	0.43	1.0		0.49
glycerol-7.0 (c:3/p:4)	M		1	4	1	3	0		-0.05	0.43	1.0		0.46