MassBank Record: MSBNK-AGILENT-AG000010
ACCESSION: MSBNK-AGILENT-AG000010
RECORD_TITLE: Diazinon (Dimpylate); ESI-QTOF; MS2; CE: 40; [M+H]+
DATE: 2023.02.17
AUTHORS: Rennie E, McEachran A, Agilent Technologies
LICENSE: CC BY
CH$NAME: Diazinon (Dimpylate)
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H21N2O3PS
CH$EXACT_MASS: 304.10105
CH$SMILES: CC1=CC(=NC(=N1)C(C)C)OP(=S)(OCC)OCC
CH$IUPAC: InChI=1S/C12H21N2O3PS/c1-6-15-18(19,16-7-2)17-11-8-10(5)13-12(14-11)9(3)4/h8-9H,6-7H2,1-5H3
CH$LINK: CAS
333-41-5
CH$LINK: CHEMSPIDER
2909
CH$LINK: INCHIKEY
FHIVAFMUCKRCQO-UHFFFAOYSA-N
AC$INSTRUMENT: N/A
AC$INSTRUMENT_TYPE: ESI-QTOF
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 40
MS$FOCUSED_ION: PRECURSOR_M/Z 305.1083262233
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-0002-9500000000-6a70d6c437c33d7a7912
PK$NUM_PEAK: 16
PK$PEAK: m/z int. rel.int.
64.978692 2.484402 24
66.033826 5.107792 51
70.065436 7.577421 75
78.940198 3.105672 31
80.973607 2.813412 28
84.04439 10.389245 103
93.044725 15.726905 157
96.950763 99.999998 999
100.021546 14.767742 147
124.982063 1.154483 11
135.091675 8.539626 85
138.078764 1.912998 19
153.102239 27.114301 270
154.110065 1.760632 17
169.079396 30.778124 307
170.08117 2.206509 22
//