ACCESSION: MSBNK-MSSJ-MSJ01069
RECORD_TITLE: Acephate; GC-EI-Q; MS; Positive; M+*
DATE: 2017.07.13 (Created 2016.12.28)
AUTHORS: Shimadzu Corporation., Kyoto, Japan
LICENSE: CC BY
COPYRIGHT: Shimadzu Cooperation., Kyoto, Japan
PUBLICATION: Shimadzu Collection of Pesticide GCMS Data

CH$NAME: Acephate
CH$COMPOUND_CLASS: Non-Natural Product; Pesticides
CH$FORMULA: C₄H₁₀NO₃PS
CH$EXACT_MASS: 183.01190
CH$SMILES: CC(=O)NP(=O)(OC)SC
CH$IUPAC: InChI=1S/C4H10NO3PS/c1-4(6)5-9(7,8-2)10-3/h1-3H3,(H,5,6,7)
CH$LINK: INCHIKEY YASYVMFAVPKPKE-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:1982
CH$LINK: COMPTOX DTXSID8023846

AC$INSTRUMENT: GCMS-QP2010 Plus, Shimadzu
AC$INSTRUMENT_TYPE: GC-EI-Q
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION EI
AC$CHROMATOGRAPHY: COLUMN_NAME Ptx-5MS(RESTEK), 0.32 mm I.D. x 30 m, df=0.25 microm
AC$CHROMATOGRAPHY: COLUMN_TEMPERATURE 80 C (1 min)-20 C/min - 180 C - 5 C/min - 330C (10 min)
AC$CHROMATOGRAPHY: INJECTION_TEMPERATURE 260 C
AC$CHROMATOGRAPHY: RETENTION_TIME 5.60 min

MS$FOCUSED_ION: ION_TYPE [M]+*
MS$FOCUSED_ION: PRECURSOR_M/Z 183.01

PK$SPLASH: splash10-0006-9300000000-8dd03ecfc791e2a83e25
PK$NUM_PEAK: 109
PK$PEAK: m/z int. rel.int.
  40 8 8
  41 418 418
  42 806 806
  43 681 681
  45 107 107
  46 97 97
  47 283 283
  48 118 118
  51 5 5
  53 10 10
  56 134 134
  57 51 51
  58 102 102
  59 7 7
  60 34 34
  61 11 11
  62 82 82
  64 49 49
  65 33 33
  66 24 24
  68 37 37
  70 9 9
  76 26 26
  77 24 24
  79 112 112
  80 26 26
  81 30 30
  86 51 51
  90 9 9
  94 370 370
  95 289 289
  96 206 206
  97 47 47
  98 7 7
  101 9 9
  104 31 31
  105 37 37
  106 41 41
  109 35 35
  110 36 36
  112 11 11
  119 32 32
  121 16 16
  124 53 53
  125 81 81
  128 7 7
  130 16 16
  131 20 20
  134 20 20
  136 999 999
  137 57 57
  138 18 18
  141 5 5
  142 102 102
  144 6 6
  154 6 6
  155 18 18
  160 7 7
  164 5 5
  172 23 23
  174 18 18
  179 31 31
  210 65 65
  228 9 9
  235 11 11
  241 14 14
  247 9 9
  260 5 5
  264 9 9
  275 15 15
  282 8 8
  287 18 18
  290 5 5
  307 7 7
  313 10 10
  315 8 8
  316 8 8
  333 14 14
  335 15 15
  339 8 8
  354 13 13
  366 10 10
  367 5 5
  381 18 18
  390 14 14
  391 5 5
  426 5 5
  429 5 5
  440 9 9
  442 7 7
  448 5 5
  452 7 7
  455 5 5
  462 10 10
  465 5 5
  471 6 6
  475 6 6
  478 5 5
  482 5 5
  516 7 7
  530 19 19
  531 6 6
  539 6 6
  550 7 7
  560 5 5
  563 5 5
  566 6 6
  590 9 9
  594 19 19
//