MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP009631
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009631
RECORD_TITLE: ETHYL 4-AMINOBENZOATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: THE INSTITUTE OF SCIENTIFIC AND INDUSTRIALRESEARCH
LICENSE: CC BY-NC-SA
CH$NAME: ETHYL 4-AMINOBENZOATE
CH$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$INSTRUMENT: JEOL JMS-DX-300
AC$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$SPLASH: splash10-00di-5900000000-dcd2847110af7c87bf18
PK$NUM_PEAK: 25
PK$PEAK: m/z int. rel.int.
26 1.3 13
27 4.8 48
29 4.4 44
39 0.62 6
40 1.2 12
41 1.9 19
44 1.7 17
52 0.16 2
63 2.8 28
64 3 30
65 22.8 228
66 0.36 4
91 3.7 37
92 24.2 242
93 5.9 59
108 0.21 2
119 1.1 11
120 99.99 999
121 11.5 115
137 1.61 16
138 1.2 12
150 1.3 13
164 1.2 12
165 4.7 47
166 4.8 48
//