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Bicyclo[3.2.0]hept-2-en-6-one, 7-(1,1-dimethylethyl)-5-methyl-, (1.alpha.,5.alpha.,7.beta.)-
SpectraBase Compound ID GsK42YZmuY1
InChI InChI=1S/C12H18O/c1-11(2,3)9-8-6-5-7-12(8,4)10(9)13/h5-6,8-9H,7H2,1-4H3
InChIKey CRLNEHDVEJAPHF-UHFFFAOYSA-N
Mol Weight 178.27 g/mol
Molecular Formula C12H18O
Exact Mass 178.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JZ6Iuz2rZWQ
Name Bicyclo[3.2.0]hept-2-en-6-one, 7-(1,1-dimethylethyl)-5-methyl-, (1.alpha.,5.alpha.,7.beta.)-
Alternate Name(s) 7-exo-t-Butyl-5-methylbicyclo[3.2.0]hept-2-en-6-one 7-endo-t-butyl-5-methylbicyclo[3.2.0]hept-2-en-6-one 7-tert-Butyl-5-methylbicyclo[3.2.0]hept-2-en-6-one
CAS Registry Number 73541-02-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O
InChI InChI=1S/C12H18O/c1-11(2,3)9-8-6-5-7-12(8,4)10(9)13/h5-6,8-9H,7H2,1-4H3
InChIKey CRLNEHDVEJAPHF-UHFFFAOYSA-N
Molecular Weight 178.275 g/mol
SMILES C1(C2(CC=CC2C1C(C)(C)C)C)=O
SPLASH splash10-0002-9200000000-69fe33084acfe769d8b1
Source of Spectrum AN-88-920-0
Wiley ID 1174615