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Cyclolaurenol
SpectraBase Compound ID EOmnj5UcDUE
InChI InChI=1S/C15H19BrO/c1-9-6-12(16)11(7-13(9)17)14(2)5-4-10-8-15(10,14)3/h6-7,10,17H,4-5,8H2,1-3H3/t10-,14+,15+/m1/s1
InChIKey JRJXKJHWKWCZNE-ONERCXAPSA-N
Mol Weight 295.22 g/mol
Molecular Formula C15H19BrO
Exact Mass 294.061928 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7N5wqFf8SUi
Name Cyclolaurenol
CAS Registry Number 103439-83-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H19BrO
InChI InChI=1S/C15H19BrO/c1-9-6-12(16)11(7-13(9)17)14(2)5-4-10-8-15(10,14)3/h6-7,10,17H,4-5,8H2,1-3H3/t10-,14+,15+/m1/s1
InChIKey JRJXKJHWKWCZNE-ONERCXAPSA-N
Molecular Weight 295.220 g/mol
SMILES Oc1cc([C@]2([C@]3(C[C@]3(CC2)[H])C)C)c(cc1C)Br
SPLASH splash10-00b9-0690000000-8eedb0f059acbe1d5b24
Source of Spectrum J-51-3365-3
Synonyms 4-Bromanyl-5-[(1R,4R,5S)-4,5-dimethyl-4-bicyclo[3.1.0]hexanyl]-2-methyl-phenol 4-Bromo-5-[(1R,4R,5S)-4,5-dimethyl-4-bicyclo[3.1.0]hexanyl]-2-methyl-phenol 4-Bromo-5-[(1S,2R,5R)-1,2-dimethylbicyclo[3.1.0]hex-2-yl]-2-methylphenol 4-Bromo-5-[(1S,2R,5R)-1,2-dimethyl-2-bicyclo[3.1.0]hexanyl]-2-methylphenol 4-Bromanyl-5-[(1S,2R,5R)-1,2-dimethyl-2-bicyclo[3.1.0]hexanyl]-2-methyl-phenol
Wiley ID 1296992