Biochanin_A; LC-ESI-ITFT; MS; [M+H]+; isotope pattern

Computational Annotation of MS Peaks (CAMP)

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Atom-Mass pairs

Submission id: CE000050

Outputs for Biochanin_A; LC-ESI-ITFT; MS; [M+H]+; isotope pattern

Database: MPI for Chemical Ecology, Jena, Germany
Entry ID: CE000050
Synonyms: Biochanin_A
Total mass: 284.263
Formula: H12 C16 O5

Experimental information

MS type: MS
Instrument: LTQ Orbitrap XL, Thermo Scientfic; HP-1100 HPLC, Agilent
Instrument type: LC-ESI-ITFT
Ionization: ESI
Ionization mode: POSITIVE

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks: 288.083801,
Replicated queried mass peaks: 286.078949, 287.080902,
Processing time: 0:00:00.373867

Results for the quried mass "285.07605"

Formula	Mass differences	Num. used protons	Num. required extra protons	Atom names
C16O5	0.195	13	1	C1,C2,C3,C4,C5,C6,C7,C8,C9,C10,C11,C12,C13,C14,C15,C16,O17,O18,O19,O20,O21