Bergapten; LC-ESI-QTOF; MS2; CE 40 ev; [M+H]+

Computational Annotation of MS Peaks (CAMP)

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Atom-Mass pairs

Submission id: BML00719

Outputs for Bergapten; LC-ESI-QTOF; MS2; CE 40 ev; [M+H]+

Database: Institute of Biological Chemistry, Washington State University
Entry ID: BML00719
Synonyms: Bergapten
Total mass: 216.1892
Formula: H8 C12 O4

Experimental information

MS type: MS2
Instrument: Agilent 1200 RRLC; Agilent 6520 QTOF
Instrument type: LC-ESI-QTOF
Ionization mode: POSITIVE

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks:
Replicated queried mass peaks: 102.0445, 105.0347, 117.0331, 118.0748, 118.0938, 118.1426, 119.0145, 120.0173, 128.025, 129.0314, 146.034, 146.0681, 174.0294,
Processing time: 0:00:02.243980

Results for the quried mass "118.041"

Formula	Mass differences	Num. used protons	Num. required extra protons	Atom names
C7O2	0.048	2	0	C1,C4,C5,C6,C8,C9,C12,O14,O15
C7O2	0.048	2	0	C1,C4,C5,C7,C8,C9,C12,O14,O15