MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP011918
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011918
RECORD_TITLE: GLYCINE ETHYL ESTER HYDROCHLORIDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: GLYCINE ETHYL ESTER HYDROCHLORIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C4H10ClNO2
CH$EXACT_MASS: 139.04001
CH$SMILES: CCOC(=O)CN.Cl
CH$IUPAC: InChI=1S/C4H9NO2.ClH/c1-2-7-4(6)3-5;/h2-3,5H2,1H3;1H
CH$LINK: CAS
623-33-6
CH$LINK: NIKKAJI
J138.915G
CH$LINK: INCHIKEY
TXTWXQXDMWILOF-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID8052300
AC$INSTRUMENT: HITACHI M-2500
AC$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$SPLASH: splash10-001i-9000000000-8ae5d06a0333d8c50cb3
PK$NUM_PEAK: 19
PK$PEAK: m/z int. rel.int.
14 1.66 17
25 1.83 18
27 6.94 69
28 1.86 19
29 4.35 44
30 99.99 999
31 2.86 29
35 3.7 37
36 19.91 199
37 1.4 14
38 7.83 78
40 1.19 12
42 2.53 25
43 1.49 15
45 2.28 23
46 1.44 14
60 2.93 29
74 1.92 19
104 6.49 65
//
system version 2.2.6-SNAPSHOT