MassBank Record: JP007648

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

ACCESSION: JP007648
RECORD_TITLE: ENDO-NORBORNEOL; EI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: ENDO-NORBORNEOL CH$NAME: ENDO-BICYCLO(2.2.1)HEPTAN-2-OL CH$COMPOUND_CLASS: N/A CH$FORMULA: C7H12O CH$EXACT_MASS: 112.08882 CH$SMILES: OC(C1)C(C2)CC(C2)1 CH$IUPAC: InChI=1S/C7H12O/c8-7-4-5-1-2-6(7)3-5/h5-8H,1-4H2/t5-,6+,7-/m1/s1 CH$LINK: INCHIKEY ZQTYQMYDIHMKQB-DSYKOEDSSA-N
AC$INSTRUMENT: HITACHI RMU-6M AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 15 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-00kf-9000000000-ca1ad94b6e27d5b0b522 PK$NUM_PEAK: 27 PK$PEAK: m/z int. rel.int. 43 1.41 14 44 1.18 12 45 3.12 31 54 1 10 55 3.12 31 56 4.71 47 57 8.01 80 58 1.89 19 66 35.35 354 67 17.85 179 68 32.11 321 69 2.95 30 70 6.6 66 71 2.95 30 79 39.65 397 80 3.42 34 81 5.48 55 82 1.06 11 83 6.48 65 84 3.89 39 93 2.42 24 94 99.99 999 95 7.31 73 97 3.77 38 108 1.18 12 111 1.24 12 112 4.01 40 //