MassBank Record: MSBNK-AGILENT-AG000012
ACCESSION: MSBNK-AGILENT-AG000012
RECORD_TITLE: Diazinon (Dimpylate); ESI-QTOF; MS2; CE: 20; [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$MASS_SPECTROMETRY: COLLISION_ENERGY 20
MS$FOCUSED_ION: PRECURSOR_M/Z 305.1083262233
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-0gba-2920000000-f8cdda3a1aefff648ea2
PK$NUM_PEAK: 20
PK$PEAK: m/z int. rel.int.
84.04439 1.290853 12
93.044725 1.32586 13
96.950763 62.821333 627
100.021546 1.744515 17
109.004907 1.276374 12
124.982063 23.964184 239
135.091675 2.672496 26
153.01171 3.527473 35
153.102239 80.347013 802
154.110065 6.853367 68
169.079396 99.999997 999
170.08117 7.735342 77
181.13354 1.628543 16
215.057695 1.252778 12
231.034851 7.247437 72
249.045415 33.335169 333
250.05018 2.853972 28
277.077026 12.324487 123
278.084851 1.377285 13
305.108326 11.1735 111
//