MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP003192

ZOXAZOLAMINE; CI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003192
RECORD_TITLE: ZOXAZOLAMINE; CI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YOSHIZUMI H, FAC. OF PHARMACY, MEIJO UNIV.
LICENSE: CC BY-NC-SA

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CH$NAME: ZOXAZOLAMINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₇H₅ClN₂O
CH$EXACT_MASS: 168.00904
CH$SMILES: Nc(o1)nc(c2)c(ccc(Cl)2)1
CH$IUPAC: InChI=1S/C7H5ClN2O/c8-4-1-2-6-5(3-4)10-7(9)11-6/h1-3H,(H2,9,10)
CH$LINK: INCHIKEY YGCODSQDUUUKIV-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID1045245

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AC$INSTRUMENT: Unknown
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: REAGENT_GAS ISOBUTANE

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PK$SPLASH: splash10-014i-0900000000-2c1d5e657b1fb0a78cd7
PK$NUM_PEAK: 5
PK$PEAK: m/z int. rel.int.
  168 8 80
  169 99.99 999
  170 11 110
  171 32 320
  172 3 30
//