MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP000082
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000082
RECORD_TITLE: ETHYL PARA AMINO BENZOATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA
CH$NAME: ETHYL PARA AMINO BENZOATE
CH$NAME: PARA AMINO BENZOIC ACID ETHYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H11NO2
CH$EXACT_MASS: 165.07898
CH$SMILES: CCOC(=O)c(c1)ccc(N)c1
CH$IUPAC: InChI=1S/C9H11NO2/c1-2-12-9(11)7-3-5-8(10)6-4-7/h3-6H,2,10H2,1H3
CH$LINK: INCHIKEY
BLFLLBZGZJTVJG-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID8021804
AC$INSTRUMENT: HITACHI RMU-7M
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: splash10-00di-4900000000-9341302295e361a20bfd
PK$NUM_PEAK: 18
PK$PEAK: m/z int. rel.int.
27 1.87 19
29 1.78 18
39 7.12 71
41 2.06 21
52 1.12 11
63 2.72 27
64 2.81 28
65 23.43 234
91 2.44 24
92 29.62 296
93 4.31 43
119 3.37 34
120 99.99 999
121 9.93 99
137 16.87 169
138 0.75 8
165 25.3 253
166 2.16 22
//