ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000555
RECORD_TITLE: EXO-NORBORNEOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HASHIMOTO K, KYOTO COLLEGE OF PHARMACY
LICENSE: CC BY-NC-SA

CH$NAME: EXO-NORBORNEOL
CH$NAME: ISONORBORNEOL
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-VQVTYTSYSA-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$SPLASH: splash10-014l-9000000000-7cd05467dba26eb028ec
PK$NUM_PEAK: 32
PK$PEAK: m/z int. rel.int.
  29 2.46 25
  39 1.04 10
  40 6.75 68
  41 2.54 25
  42 5.15 52
  43 2.38 24
  44 3.86 39
  52 4.07 41
  53 2.12 21
  54 10.46 105
  55 7.33 73
  56 15.31 153
  58 4.7 47
  66 46.98 470
  67 43.64 436
  68 46.92 469
  69 6.19 62
  70 10.48 105
  71 4.74 47
  77 1.47 15
  79 59.73 597
  80 4.48 45
  81 10.06 101
  82 1.27 13
  83 16.13 161
  84 6.44 64
  93 4.11 41
  94 99.99 999
  95 8.98 90
  97 6.16 62
  111 1.39 14
  112 2.28 23
//