MassBank Record: JP006717



 N-(3,3-DIDEUTERO-3-PHENYLPROPIONYL)PIPERIDIN-2-ONE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP006717
RECORD_TITLE: N-(3,3-DIDEUTERO-3-PHENYLPROPIONYL)PIPERIDIN-2-ONE; EI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: , MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: N-(3,3-DIDEUTERO-3-PHENYLPROPIONYL)PIPERIDIN-2-ONE CH$COMPOUND_CLASS: N/A CH$FORMULA: C14H17NO2 CH$EXACT_MASS: 231.12593 CH$SMILES: O=C(C2)N(CCC2)C(=O)CC([2H])([2H])c(c1)cccc1 CH$IUPAC: InChI=1S/C14H17NO2/c16-13-8-4-5-11-15(13)14(17)10-9-12-6-2-1-3-7-12/h1-3,6-7H,4-5,8-11H2/i9D2 CH$LINK: INCHIKEY ZVNUABIDENQZES-KNXIQCGSSA-N
AC$INSTRUMENT: HITACHI RMU-6G 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: splash10-0zfr-2920000000-d5c83a29c3a28d90d544 PK$NUM_PEAK: 40 PK$PEAK: m/z int. rel.int. 55 8 80 56 6 60 57 4 40 70 2 20 71 6 60 72 3 30 78 2 20 79 3 30 80 2 20 81 3 30 82 5 50 83 1 10 84 5 50 85 2 20 91 2 20 92 2 20 93 26 260 94 2 20 98 6 60 99 14 140 100 52 520 101 99.99 999 102 10 100 104 4 40 105 70 700 106 19 190 107 19 190 112 16 160 113 5 50 114 2 20 132 4 40 133 9 90 134 7 70 135 2 20 140 4 40 141 3 30 233 36 360 234 19 190 235 17 170 236 3 30 //

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