MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP005879
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005879
RECORD_TITLE: PROPIONYL CHLORIDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: PROPIONYL CHLORIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C3H5ClO
CH$EXACT_MASS: 92.00289
CH$SMILES: CCC(=O)Cl
CH$IUPAC: InChI=1S/C3H5ClO/c1-2-3(4)5/h2H2,1H3
CH$LINK: INCHIKEY
RZWZRACFZGVKFM-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID4058819
AC$INSTRUMENT: HITACHI RMU-6M
AC$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$SPLASH: splash10-004i-9000000000-040e44567e9171c6e4c7
PK$NUM_PEAK: 22
PK$PEAK: m/z int. rel.int.
25 3.8 38
26 19 190
27 60.32 603
28 15.06 151
29 99.99 999
30 2.53 25
35 1.97 20
36 1 10
37 1.41 14
38 1.12 11
39 1.26 13
41 1 10
42 3.8 38
44 2.11 21
49 1.69 17
53 1.12 11
55 1.97 20
56 1.83 18
57 80.21 802
58 2.81 28
63 8.02 80
65 2.67 27
//