MassBank Record: JP002256



 2-(1-METHOXYBENZYL)CYCLOPENTANONE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP002256
RECORD_TITLE: 2-(1-METHOXYBENZYL)CYCLOPENTANONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: 2-(1-METHOXYBENZYL)CYCLOPENTANONE CH$COMPOUND_CLASS: N/A CH$FORMULA: C13H16O2 CH$EXACT_MASS: 204.11503 CH$SMILES: COC(c(c2)cccc2)C(C1)C(=O)CC1 CH$IUPAC: InChI=1S/C13H16O2/c1-15-13(10-6-3-2-4-7-10)11-8-5-9-12(11)14/h2-4,6-7,11,13H,5,8-9H2,1H3
AC$INSTRUMENT: JEOL JMS-D-3000 AC$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$SPLASH: splash10-00di-2900000000-d8d799df3f792d0d2c43 PK$NUM_PEAK: 21 PK$PEAK: m/z int. rel.int. 40 2.76 28 42 1.69 17 44 1.08 11 51 2.28 23 55 1.13 11 65 1.69 17 77 9.91 99 78 2 20 91 8.14 81 105 4.01 40 115 4.23 42 116 2.23 22 117 2.63 26 121 99.99 999 122 9.3 93 128 1.46 15 129 2.28 23 130 2.79 28 171 2.4 24 172 2.81 28 204 0.6 6 //