MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP010786
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010786
RECORD_TITLE: PROPIONAMIDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: FUJISE Y, HAMAMATSU UNIV. SCHOOL OF MEDICINE
LICENSE: CC BY-NC-SA
CH$NAME: PROPIONAMIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C3H7NO
CH$EXACT_MASS: 73.05276
CH$SMILES: CCC(N)=O
CH$IUPAC: InChI=1S/C3H7NO/c1-2-3(4)5/h2H2,1H3,(H2,4,5)
CH$LINK: INCHIKEY
QLNJFJADRCOGBJ-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID3058820
AC$INSTRUMENT: JEOL JMS-D-300
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0006-9000000000-267e4a1338b305b8087d
PK$NUM_PEAK: 11
PK$PEAK: m/z int. rel.int.
43 2.06 21
44 99.99 999
45 4.79 48
54 1.47 15
55 5.32 53
56 2.68 27
57 17.07 171
72 8.32 83
73 46.79 468
74 1.93 19
191 1.19 12
//