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4-(2,4,4-Trimethylbicyclo[4.1.0]hept-2-en-3-yl)-2-butanone
SpectraBase Compound ID IHCSrDe0IHH
InChI InChI=1S/C14H22O/c1-9(15)5-6-13-10(2)12-7-11(12)8-14(13,3)4/h11-12H,5-8H2,1-4H3
InChIKey NISXIUTZLBSNCF-UHFFFAOYSA-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 7cwlSQkr4Ev
Name 4-(2,4,4-Trimethylbicyclo[4.1.0]hept-2-en-3-yl)-2-butanone
CAS Registry Number 79718-87-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O
InChI InChI=1S/C14H22O/c1-9(15)5-6-13-10(2)12-7-11(12)8-14(13,3)4/h11-12H,5-8H2,1-4H3
InChIKey NISXIUTZLBSNCF-UHFFFAOYSA-N
Molecular Weight 206.329 g/mol
SMILES C1C2CC(C)(C)C(CCC(=O)C)=C(C)C12
SPLASH splash10-001l-5900000000-a8e2d7aa9365e90ebe09
Synonyms 4-(2,4,4-Trimethyl-bicyclo[4.1.0]hept-2-en-3-yl)-butan-2-one 4-(3,3,5-trimethyl-4-bicyclo[4.1.0]hept-4-enyl)-2-butanone 4-(3,3,5-trimethyl-4-bicyclo[4.1.0]hept-4-enyl)butan-2-one
Wiley ID 1480259