MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP006374
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006374
RECORD_TITLE: CYCLOPROPYL METHYL KETONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HISAHIRO HAGIWARA, CHEMICAL RESEARCH INSTITUTE OF NON-AQUEOUSSOLUTIONS TOHOKU UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: CYCLOPROPYL METHYL KETONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C5H8O
CH$EXACT_MASS: 84.05751
CH$SMILES: CC(=O)C(C1)C1
CH$IUPAC: InChI=1S/C5H8O/c1-4(6)5-2-3-5/h5H,2-3H2,1H3
CH$LINK: CAS
765-43-5
CH$LINK: INCHIKEY
HVCFCNAITDHQFX-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID9074854
AC$INSTRUMENT: JEOL JMS-DX-300
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: splash10-00kf-9000000000-230b5cc14d7e85f79544
PK$NUM_PEAK: 16
PK$PEAK: m/z int. rel.int.
37 1.55 16
38 3.69 37
39 25.79 258
40 1.06 11
41 55.23 552
42 7.82 78
43 99.99 999
44 1.68 17
51 1.05 11
53 1.63 16
55 2.35 24
69 77.81 778
70 3.85 39
83 3.79 38
84 27.25 273
85 1.74 17
//