MassBank Record: JP008177

Home Search Record Index Data Privacy Imprint


DIMETHYL SULFOXIDE; EI-B; MS
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n
metabolomics-usi visualisation

ACCESSION: JP008177
RECORD_TITLE: DIMETHYL SULFOXIDE; EI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: NARA WOMEN'S UNIVERSITY
LICENSE: CC BY-NC-SA

CH$NAME: DIMETHYL SULFOXIDE CH$NAME: METHYL SULFOXIDE CH$COMPOUND_CLASS: N/A CH$FORMULA: C2H6OS CH$EXACT_MASS: 78.01394 CH$SMILES: CS(C)=O CH$IUPAC: InChI=1S/C2H6OS/c1-4(2)3/h1-2H3 CH$LINK: CAS 67-68-5 CH$LINK: INCHIKEY IAZDPXIOMUYVGZ-UHFFFAOYSA-N CH$LINK: COMPTOX DTXSID2021735
AC$INSTRUMENT: HITACHI M-80 AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-03fs-9000000000-945240052686ea267e2b PK$NUM_PEAK: 28 PK$PEAK: m/z int. rel.int. 13 2.48 25 14 8.78 88 15 33.76 338 26 1.03 10 27 5.46 55 28 2.28 23 29 9.28 93 31 6.44 64 32 3.62 36 33 4.21 42 34 4.54 45 35 5.84 58 44 3.53 35 45 47.22 472 46 13.65 137 47 11.14 111 48 10.06 101 49 1.56 16 58 1.3 13 59 1.01 10 61 17.03 170 62 6.78 68 63 99.99 999 64 2.65 27 65 4.51 45 78 79.06 791 79 10.77 108 80 4.3 43 //