MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP000559
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000559
RECORD_TITLE: BENZAMIDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HASHIMOTO K, KYOTO COLLEGE OF PHARMACY
LICENSE: CC BY-NC-SA
CH$NAME: BENZAMIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C7H7NO
CH$EXACT_MASS: 121.05276
CH$SMILES: NC(=O)c(c1)cccc1
CH$IUPAC: InChI=1S/C7H7NO/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H2,8,9)
CH$LINK: COMPTOX
DTXSID0021709
CH$LINK: INCHIKEY
KXDAEFPNCMNJSK-UHFFFAOYSA-N
CH$LINK: PUBCHEM
CID:2331
AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0ab9-2900000000-d10a8514e7c0dedd5758
PK$NUM_PEAK: 9
PK$PEAK: m/z int. rel.int.
44 1.3 13
51 3.8 38
52 1.03 10
77 46.94 469
78 6.27 63
105 99.99 999
106 7.81 78
121 86 860
122 7.5 75
//
system version 2.2.8-SNAPSHOT