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Related entries (identical compound): ML005951 JP009387 JP000532 BML82325 BML82326 BML82327 BML82328 JP008443
Submission id: ML005951

Outputs for vanillin; LC-ESI-ITFT; MS2; CE: 50%; R=7500; [M-H]-


Database: European Molecular Biology Laboratory - European Bioinformatics Institute (EMBL-EBI), Hinxton, UK.
Entry ID: ML005951
Synonyms: vanillin, 4-hydroxy-3-methoxybenzaldehyde
Total mass: 152.147
Formula: H8 C8 O3

Structure file (with ALATIS unique atom labels)

Experimental information

MS type: MS2
Instrument: LTQ Orbitrap Velos Thermo Scientific
Instrument type: LC-ESI-ITFT
Ionization: ESI
Ionization mode: NEGATIVE

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks:
Replicated queried mass peaks: 108.0218, 109.0297,
Processing time: 0:00:00.746811
Queried mass list: ['107.050', '123.045', '136.017', '151.040']



Queried massNum. matched formulasNum. matched fragments
107.0504 (link to fragments) 1 3
123.0453 (link to fragments) 2 4
136.0166 (link to fragments) 2 6
151.0401 (link to fragments) 1 1


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