MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP006727
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006727
RECORD_TITLE: N-(3-(4-NITROPHENYL)PROPIONYL)PIPERIDIN-2-ONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA
CH$NAME: N-(3-(4-NITROPHENYL)PROPIONYL)PIPERIDIN-2-ONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C14H16N2O4
CH$EXACT_MASS: 276.11101
CH$SMILES: [O-1][N+1](=O)c(c1)ccc(CCC(=O)N(C2)C(=O)CCC2)c1
CH$IUPAC: InChI=1S/C14H16N2O4/c17-13-3-1-2-10-15(13)14(18)9-6-11-4-7-12(8-5-11)16(19)20/h4-5,7-8H,1-3,6,9-10H2
CH$LINK: INCHIKEY
JBGUTKDFHSQGSH-UHFFFAOYSA-N
AC$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: splash10-0udj-6900000000-b7869c901afa683d564f
PK$NUM_PEAK: 24
PK$PEAK: m/z int. rel.int.
43 27 270
55 6 60
56 5 50
57 5 50
61 5 50
71 6 60
84 6 60
91 4 40
98 17 170
99 45 450
100 99.99 999
101 7 70
103 5 50
104 4 40
112 12 120
119 7 70
131 6 60
138 11 110
140 7.5 75
149 5 50
150 5 50
177 6 60
276 5 50
277 1 10
//
system version 2.2.6-SNAPSHOT