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1-nor-Bourbonanone
SpectraBase Compound ID BoygVfGWmPX
InChI InChI=1S/C14H22O/c1-8(2)9-6-7-14(3)10-4-5-11(15)12(10)13(9)14/h8-10,12-13H,4-7H2,1-3H3/t9-,10+,12+,13+,14-/m0/s1
InChIKey PYUWACLOPFTHBV-HNTFPEDGSA-N
Mol Weight 206.33 g/mol
Molecular Formula C14H22O
Exact Mass 206.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JEvmaZpWX5z
Name 1-nor-Bourbonanone
Alternate Name(s) Bourbonanone<1-nor->
CAS Registry Number 13844-03-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness)
GC Oven Program 60 ??C to 246 ??C at 3 ??C/min.
InChI InChI=1S/C14H22O/c1-8(2)9-6-7-14(3)10-4-5-11(15)12(10)13(9)14/h8-10,12-13H,4-7H2,1-3H3/t9-,10+,12+,13+,14-/m0/s1
InChIKey PYUWACLOPFTHBV-HNTFPEDGSA-N
Molecular Weight 206.329 g/mol
SMILES [C@]12([C@](C(=O)CC2)([C@@]2([C@]1(CC[C@]2(C(C)C)[H])C)[H])[H])[H]
SPLASH splash10-001i-9200000000-1ddbcb94e602ba46fed4
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1885958