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Bicyclo[3.1.1]hept-2-en-2-ol, 3,6,6-trimethyl-, acetate
SpectraBase Compound ID A4inqARbblQ
InChI InChI=1S/C12H18O2/c1-7-5-9-6-10(12(9,3)4)11(7)14-8(2)13/h9-10H,5-6H2,1-4H3
InChIKey CJWHRQNJCKUILO-UHFFFAOYSA-N
Mol Weight 194.27 g/mol
Molecular Formula C12H18O2
Exact Mass 194.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BLN1rSpkior
Name Bicyclo[3.1.1]hept-2-en-2-ol, 3,6,6-trimethyl-, acetate
Alternate Name(s) 3,6,6-trimethylbicyclo[3.1.1]hept-2-en-2-yl acetate cis-2-acetoxy-3,6,6-trimethylbicyclo(3.1.1)hept-2-ene
CAS Registry Number 57022-52-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O2
InChI InChI=1S/C12H18O2/c1-7-5-9-6-10(12(9,3)4)11(7)14-8(2)13/h9-10H,5-6H2,1-4H3
InChIKey CJWHRQNJCKUILO-UHFFFAOYSA-N
Molecular Weight 194.274 g/mol
SMILES C=1(C2C(C)(C)C(CC1C)C2)OC(=O)C
SPLASH splash10-0a4i-4900000000-88a9752c8855d6488a5f
Source of Spectrum I-53-745-0
Wiley ID 1191039