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3-THUJANOL (ISOMER)
SpectraBase Compound ID 2am98OlDc3j
InChI InChI=1S/C10H18O/c1-6(2)10-4-8(10)7(3)9(11)5-10/h6-9,11H,4-5H2,1-3H3
InChIKey DZVXRFMREAADPP-UHFFFAOYSA-N
Mol Weight 154.25 g/mol
Molecular Formula C10H18O
Exact Mass 154.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID StcsRmBXID
Name Bicyclo[3.1.0]hexan-3-ol, 4-methyl-1-(1-methylethyl)-
CAS Registry Number 31187-53-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18O
InChI InChI=1S/C10H18O/c1-6(2)10-4-8(10)7(3)9(11)5-10/h6-9,11H,4-5H2,1-3H3
InChIKey DZVXRFMREAADPP-UHFFFAOYSA-N
Molecular Weight 154.253 g/mol
SMILES OC1CC2(C(C)C)C(C1C)C2
SPLASH splash10-006x-9500000000-32835b65f7b56624d6e4
Source of Spectrum AA-0-941-4
Synonyms 1-Isopropyl-4-methylbicyclo[3.1.0]hexan-3-ol Bicyclo[3.1.0]hexan-3-ol, 4-methyl-1-(1-methylethyl)-, (1.alpha.,3.beta.,4.beta.,5.alpha.)- 4-Methyl-1-(1-methylethyl)bicyclo(3.1.0)hexan-3-ol Isothujol Neoisothujol Neoisothujyl alcohol 4-Methyl-1-propan-2-yl-3-bicyclo[3.1.0]hexanol Thujyl alcohol 4-Methyl-1-propan-2-ylbicyclo[3.1.0]hexan-3-ol 4-Methyl-1-propan-2-yl-bicyclo[3.1.0]hexan-3-ol
Wiley ID 1151929