MassBank Record: JP002471



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

ACCESSION: JP002471
RECORD_TITLE: D-CAMPHOLIC ACID; 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$NAME: D-CAMPHOLIC ACID CH$NAME: (D)-TRANS-1,2,2,3-TETRAMETHYLCYCLOPENTANECARBOXYLIC ACID CH$COMPOUND_CLASS: N/A CH$FORMULA: C10H18O2 CH$EXACT_MASS: 170.13068 CH$SMILES: OC(=O)C(C)(C1)C(C)(C)C([H])(C)C1 CH$IUPAC: InChI=1S/C10H18O2/c1-7-5-6-10(4,8(11)12)9(7,2)3/h7H,5-6H2,1-4H3,(H,11,12)/t7-,10+/m1/s1
AC$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: splash10-00lr-9000000000-7e708060dec5f0ea6624 PK$NUM_PEAK: 38 PK$PEAK: m/z int. rel.int. 42 2.55 26 43 11.66 117 45 6.97 70 53 3.67 37 55 15.86 159 56 6.43 64 57 2.81 28 58 1.86 19 59 10.48 105 67 4.77 48 68 2.1 21 69 73.71 737 70 9.43 94 71 2.33 23 73 1.93 19 74 5 50 77 1.13 11 79 1.27 13 81 3.22 32 82 1.83 18 83 6.83 68 84 99.99 999 85 7.89 79 87 16.71 167 95 2.21 22 96 9.69 97 97 9.12 91 99 2.32 23 100 2.85 29 101 1.24 12 109 7.39 74 110 1.5 15 113 3.3 33 114 3.97 40 115 1.12 11 127 1.97 20 152 1.41 14 170 4.68 47 //