MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP002378
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002378
RECORD_TITLE: N-BENZYL-3-ETHOXYCARBONYLPYRROLIDINE; 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$NAME: N-BENZYL-3-ETHOXYCARBONYLPYRROLIDINE
CH$NAME: ETHYL 1-BENZYLPYRROLIDINE-3-CARBOXYLATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C14H19NO2
CH$EXACT_MASS: 233.14158
CH$SMILES: CCOC(=O)C(C2)CN(C2)Cc(c1)cccc1
CH$IUPAC: InChI=1S/C14H19NO2/c1-2-17-14(16)13-8-9-15(11-13)10-12-6-4-3-5-7-12/h3-7,13H,2,8-11H2,1H3
CH$LINK: INCHIKEY
CYPXEPWPTXKUPL-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID60973004
AC$INSTRUMENT: JEOL JMS-D-3000
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: splash10-0006-9400000000-2688c8fccc692b1a9bc0
PK$NUM_PEAK: 28
PK$PEAK: m/z int. rel.int.
42 28.25 283
43 1.9 19
44 2.58 26
51 2.38 24
55 3.19 32
65 12.66 127
68 9.71 97
69 2.85 29
77 2.03 20
82 2.25 23
89 2.03 20
91 99.99 999
92 12.54 125
114 2.42 24
128 3.94 39
132 6.86 69
133 2.88 29
142 50.16 502
143 4.3 43
156 9.34 93
160 2.43 24
184 3.07 31
188 13.95 140
189 1.95 20
204 4.01 40
229 2.96 30
232 4.95 50
233 5.87 59
//
system version 2.2.8-SNAPSHOT