MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP011289
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011289
RECORD_TITLE: DIMETHYL CARBONATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA
CH$NAME: DIMETHYL CARBONATE
CH$NAME: CARBONIC ACID DIMETHYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C3H6O3
CH$EXACT_MASS: 90.03169
CH$SMILES: COC(=O)OC
CH$IUPAC: InChI=1S/C3H6O3/c1-5-3(4)6-2/h1-2H3
CH$LINK: INCHIKEY
IEJIGPNLZYLLBP-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID9029192
AC$INSTRUMENT: HITACHI M-80A
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: splash10-05nb-9000000000-a91772bfccbb956b6353
PK$NUM_PEAK: 17
PK$PEAK: m/z int. rel.int.
15 70.21 702
16 1.6 16
29 47.3 473
30 7.18 72
31 59.35 594
33 8.93 89
43 1.8 18
44 3.54 35
45 99.99 999
46 2.31 23
47 1.66 17
59 56.86 569
60 6.32 63
61 4.21 42
62 6.98 70
90 7.26 73
91 3.57 36
//
system version 2.2.6-SNAPSHOT