MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP010188
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010188
RECORD_TITLE: METHYL 1-BENZYLPYRROLIDINE-3-CARBOXYLATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KANEMASA S, INST. OF ADVANCED MATERIAL STUDY KYUSHU UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: METHYL 1-BENZYLPYRROLIDINE-3-CARBOXYLATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C13H17NO2
CH$EXACT_MASS: 219.12593
CH$SMILES: COC(=O)C(C2)CN(C2)Cc(c1)cccc1
CH$IUPAC: InChI=1S/C13H17NO2/c1-16-13(15)12-7-8-14(10-12)9-11-5-3-2-4-6-11/h2-6,12H,7-10H2,1H3
CH$LINK: INCHIKEY
GDWFCUOFVSNTTG-UHFFFAOYSA-N
AC$INSTRUMENT: JEOL JMS-01-SG-2
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 75 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0006-9200000000-b935b29c9ba3b0ffceb8
PK$NUM_PEAK: 25
PK$PEAK: m/z int. rel.int.
39 7.64 76
41 8.53 85
42 38.86 389
52 4.94 49
57 5.02 50
65 15.64 156
68 5.57 56
72 30.13 301
86 4.75 48
91 99.99 999
92 15.23 152
132 7.05 71
133 5.42 54
162 9.96 100
163 6.18 62
170 29.53 295
171 3.42 34
184 2.64 26
188 5.22 52
204 6.95 70
205 1.02 10
232 1.72 17
260 1.95 20
261 5.75 58
262 1.1 11
//
system version 2.2.8-SNAPSHOT