MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP004287
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004287
RECORD_TITLE: TRIMETHYLENE OXIDE; 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$NAME: TRIMETHYLENE OXIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C3H6O
CH$EXACT_MASS: 58.04186
CH$SMILES: C(C1)CO1
CH$IUPAC: InChI=1S/C3H6O/c1-2-4-3-1/h1-3H2
CH$LINK: INCHIKEY
AHHWIHXENZJRFG-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID8025969
AC$INSTRUMENT: HITACHI RMU-7M
AC$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$SPLASH: splash10-004i-9000000000-ba9cba0da49f4e77b06e
PK$NUM_PEAK: 15
PK$PEAK: m/z int. rel.int.
25 1.41 14
26 14.93 149
27 20.94 209
28 99.99 999
29 20.56 206
30 4.69 47
31 7.23 72
39 2.63 26
41 1.41 14
42 1.5 15
43 1.22 12
44 2.72 27
57 11.36 114
58 27.51 275
59 2.16 22
//