MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP012197
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP012197
RECORD_TITLE: 1-PENTENE; CI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: IIDA Y, DAISHIMA S, FAC. OF ENGINEERING, SEIKEI UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: 1-PENTENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C5H10
CH$EXACT_MASS: 70.07825
CH$SMILES: CCCC=C
CH$IUPAC: InChI=1S/C5H10/c1-3-5-4-2/h3H,1,4-5H2,2H3
CH$LINK: CAS
109-67-1
CH$LINK: INCHIKEY
YWAKXRMUMFPDSH-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID7025849
AC$INSTRUMENT: FINNIGAN-MAT 4500
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 120 eV
AC$MASS_SPECTROMETRY: REAGENT_GAS METHANE
PK$SPLASH: splash10-05fr-9000000000-323e87fd40dd61a9d0cf
PK$NUM_PEAK: 9
PK$PEAK: m/z int. rel.int.
55 17.86 179
56 1.37 14
57 38.78 388
58 1.82 18
69 37.47 375
70 11.21 112
71 99.99 999
72 7.01 70
83 2.58 26
//