Kynurenine; LC-ESI-IT; MS2; m/z: 209.1; [M+H]+

Computational Annotation of MS Peaks (CAMP)

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Atom-Mass pairs

Submission id: MT000014

Outputs for Kynurenine; LC-ESI-IT; MS2; m/z: 209.1; [M+H]+

Database: Metabolon Inc.
Entry ID: MT000014
Synonyms: Kynurenine
Total mass: 208.2134
Formula: H12 C10 O3 N2

Experimental information

MS type: MS2
Instrument: LTQ XL, Thermo Finnigan
Instrument type: LC-ESI-IT
Ionization: ESI
Ionization mode: POSITIVE

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks:
Replicated queried mass peaks: 164.2, 192.1,
Processing time: 0:00:01.894781

Results for the quried mass "94.2"

Formula	Mass differences	Num. used protons	Num. required extra protons	Atom names
C6O1	0.089	6	1	C1,C3,C5,C6,C8,C9,O13
C6O1	0.089	6	1	C1,C2,C3,C5,C6,C9,O13
C6O1	0.089	6	1	C3,C5,C6,C8,C9,C10,O15
C5O2	0.132	2	0	C5,C6,C8,C9,C10,O14,O15
C5O2	0.132	2	0	C5,C6,C8,C9,C10,O13,O14
C5O2	0.132	2	0	C5,C6,C8,C9,C10,O13,O15
C6N1	0.066	8	1	C1,C3,C5,C6,C8,C9,N12
C8	0.130	2	0	C1,C2,C4,C5,C6,C7,C8,C9
C8	0.130	2	0	C1,C2,C3,C5,C6,C8,C9,C10
C8	0.130	2	0	C1,C2,C3,C4,C5,C6,C7,C9
C8	0.130	2	0	C1,C2,C3,C4,C5,C6,C8,C9
C8	0.130	2	0	C1,C3,C4,C5,C6,C7,C8,C9
C8	0.130	2	0	C1,C3,C5,C6,C7,C8,C9,C10
C8	0.130	2	0	C1,C2,C3,C5,C6,C7,C8,C9
C8	0.130	2	0	C2,C4,C5,C6,C7,C8,C9,C10
C8	0.130	2	0	C2,C3,C4,C5,C6,C7,C8,C9
C8	0.130	2	0	C3,C4,C5,C6,C7,C8,C9,C10
C4O2N1	0.152	0	0	C5,C8,C9,C10,N12,O13,O14
C4O2N1	0.152	0	0	C5,C8,C9,C10,N12,O13,O15
C4O2N1	0.152	0	0	C5,C8,C9,C10,N12,O14,O15
C5N2	0.086	6	0	C5,C6,C7,C8,C9,N11,N12
C5O1N1	0.109	4	0	C5,C6,C8,C9,C10,N12,O14
C5O1N1	0.109	4	0	C5,C6,C8,C9,C10,N12,O15
C5O1N1	0.109	4	0	C5,C6,C7,C8,C9,N11,O13
C5O1N1	0.109	4	0	C5,C6,C7,C8,C9,N12,O13
C5O1N1	0.109	4	0	C1,C3,C6,C7,C9,N11,O13
C5O1N1	0.109	4	0	C2,C4,C6,C7,C9,N11,O13
C5O1N1	0.109	4	0	C3,C5,C6,C8,C9,N12,O13
C5O1N1	0.109	4	0	C3,C4,C6,C7,C9,N11,O13
C5O1N1	0.109	4	0	C3,C5,C6,C7,C9,N11,O13
C4O3	0.175	2	0	C5,C8,C9,C10,O13,O14,O15