Related entries (identical compound): KO002974 KO002975 KO002976 KO002978 KO002977

Submission id: KO002975

Outputs for Gramine; LC-ESI-QQ; MS2; CE:20 V; [M+H]+

Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO002975
Synonyms: Gramine
Total mass: 174.2417
Formula: H14 C11 N2

Structure file (with ALATIS unique atom labels)

Experimental information

MS type: MS2
Instrument: API3000, Applied Biosystems
Instrument type: LC-ESI-QQ
Ionization mode: POSITIVE

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks:
Replicated queried mass peaks: 64.8, 72.1, 75.6, 84.1, 84.3, 93.8, 97.2, 116.3, 130.1, 158.1,
Processing time: 0:00:02.603924
Queried mass list: ['39.200', '46.200', '63.100', '70.100', '73.900', '80.700', '82.900', '85.900', '88.300', '92.900', '96.200', '101.800', '112.000', '115.000', '121.300', '125.000', '128.900', '140.400', '142.600', '156.900', '175.300']

Queried mass	Num. matched formulas	Num. matched fragments
39.2 (link to fragments)	2	12
46.2 (link to fragments)	1	14
63.1 (link to fragments)	3	37
70.1 (link to fragments)	1	17
73.9 (link to fragments)	2	43
80.7 (link to fragments)	2	7
82.9 (link to fragments)	2	16
85.9 (link to fragments)	2	18
88.3 (link to fragments)	3	19
92.9 (link to fragments)	2	5
96.2 (link to fragments)	3	6
101.8 (link to fragments)	2	5
112.0 (link to fragments)	3	8
115.0 (link to fragments)	2	6
121.3 (link to fragments)	3	8
125.0 (link to fragments)	3	9
128.9 (link to fragments)	2	7
140.4 (link to fragments)	2	7
142.6 (link to fragments)	2	7
156.9 (link to fragments)	2	10
175.3 (link to fragments)	1	1