CAFFEINE; CI-B; MS

Computational Annotation of MS Peaks (CAMP)

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Atom-Mass pairs

Submission id: JP003158

Outputs for CAFFEINE; CI-B; MS

Database: UNIV. OF OCCUPATIONAL AND ENVIRONMENTAL HEALTH, Tokyo
Entry ID: JP003158
Synonyms: CAFFEINE
Total mass: 194.1902
Formula: H10 C8 O2 N4

Experimental information

MS type: MS
Instrument: Unknown
Instrument type: CI-B
Ionization mode: POSITIVE

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks:
Replicated queried mass peaks: 195.0, 196.0,
Processing time: 0:00:00.740362

Results for the quried mass "194.0"

Formula	Mass differences	Num. used protons	Num. required extra protons	Atom names
C8O2N4	0.190	10	0	C1,C2,C3,C4,C5,C6,C7,C8,N9,N10,N11,N12,O13,O14