MassBank Record: JP002481



 METHYL 3-HYDROXY-4-METHYLENECYCLOHEXANECARBOXYLATE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP002481
RECORD_TITLE: METHYL 3-HYDROXY-4-METHYLENECYCLOHEXANECARBOXYLATE; 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$NAME: METHYL 3-HYDROXY-4-METHYLENECYCLOHEXANECARBOXYLATE CH$COMPOUND_CLASS: N/A CH$FORMULA: C9H14O3 CH$EXACT_MASS: 170.09429 CH$SMILES: COC(=O)C(C1)CC(O)C(=C)C1 CH$IUPAC: InChI=1S/C9H14O3/c1-6-3-4-7(5-8(6)10)9(11)12-2/h7-8,10H,1,3-5H2,2H3
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$SPLASH: splash10-03dl-9400000000-91a8b7cfacbf74ea2822 PK$NUM_PEAK: 28 PK$PEAK: m/z int. rel.int. 42 32.07 321 43 27.82 278 53 10.69 107 55 55.43 554 56 6.7 67 59 11.02 110 66 8.67 87 67 25.81 258 68 6.66 67 69 19.8 198 77 14.86 149 79 10.06 101 81 18.49 185 82 13.58 136 83 8.75 88 84 12.55 126 87 64.18 642 91 15.92 159 92 13.95 140 93 62.43 624 95 23.43 234 109 11.57 116 110 61.88 619 111 99.99 999 112 7.35 74 138 15.89 159 139 7.61 76 170 9.88 99 //