MassBank Record: JP007544



 GERANIAL; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP007544
RECORD_TITLE: GERANIAL; EI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: TAKEUCHI TDEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV., DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: GERANIAL CH$NAME: (E)-3,7-DIMETHYL-2,6-OCTADIENAL CH$COMPOUND_CLASS: N/A CH$FORMULA: C10H16O CH$EXACT_MASS: 152.12012 CH$SMILES: O=CC=C(C)CCC=C(C)C CH$IUPAC: InChI=1S/C10H16O/c1-9(2)5-4-6-10(3)7-8-11/h5,7-8H,4,6H2,1-3H3/b10-7+ CH$LINK: CAS 141-27-5 CH$LINK: INCHIKEY WTEVQBCEXWBHNA-JXMROGBWSA-N
AC$INSTRUMENT: HITACHI M-80 AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-014i-9100000000-dcdfd8342f2d4ce5a439 PK$NUM_PEAK: 13 PK$PEAK: m/z int. rel.int. 55 4.62 46 59 8.03 80 69 99.99 999 70 10.1 101 83 9.03 90 84 44.59 446 94 19.76 198 95 5.67 57 109 12.84 128 119 2.87 29 123 10.95 110 137 7.88 79 152 6 60 //