MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP003250
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003250
RECORD_TITLE: METHYL PARATHION; 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$NAME: METHYL PARATHION
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H10NO5PS
CH$EXACT_MASS: 263.00173
CH$SMILES: [O-1][N+1](=O)c(c1)ccc(c1)OP(=S)(OC)OC
CH$IUPAC: InChI=1S/C8H10NO5PS/c1-12-15(16,13-2)14-8-5-3-7(4-6-8)9(10)11/h3-6H,1-2H3
CH$LINK: INCHIKEY
RLBIQVVOMOPOHC-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID1020855
AC$INSTRUMENT: HITACHI RMU-6E
AC$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$SPLASH: splash10-06vi-3970000000-203d78f4cbba79fcaa11
PK$NUM_PEAK: 10
PK$PEAK: m/z int. rel.int.
79 47 470
93 35 350
109 86 860
125 87 870
137 17 170
200 15 150
231 9 90
232 12 120
246 15 150
263 99.99 999
//