MassBank Record: JP003640



 1,2,3-CYCLOHEXANETRIOL; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP003640
RECORD_TITLE: 1,2,3-CYCLOHEXANETRIOL; EI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: , MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: 1,2,3-CYCLOHEXANETRIOL CH$COMPOUND_CLASS: N/A CH$FORMULA: C6H12O3 CH$EXACT_MASS: 132.07864 CH$SMILES: OC(C1)C(O)C(O)CC1 CH$IUPAC: InChI=1S/C6H12O3/c7-4-2-1-3-5(8)6(4)9/h4-9H,1-3H2 CH$LINK: INCHIKEY IZSANPWSFUSNMY-UHFFFAOYSA-N
AC$INSTRUMENT: Unknown AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0ab9-9000000000-f5203eaf34637cf939f7 PK$NUM_PEAK: 9 PK$PEAK: m/z int. rel.int. 43 25.5 255 57 99.5 995 58 49.6 496 70 99.99 999 83 26.3 263 86 27.2 272 96 27.9 279 114 6.28 63 132 4 40 //

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