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2,5,5-Trimethyl-cyclohex-3-enone
SpectraBase Compound ID Cj4R49aapvU
InChI InChI=1S/C9H14O/c1-7-4-5-9(2,3)6-8(7)10/h4-5,7H,6H2,1-3H3
InChIKey IVSKDXCSHZLVON-UHFFFAOYSA-N
Mol Weight 138.21 g/mol
Molecular Formula C9H14O
Exact Mass 138.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Z1Yr9fALQ
Name 2,5,5-Trimethyl-cyclohex-3-enone
CAS Registry Number 58795-34-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14O
InChI InChI=1S/C9H14O/c1-7-4-5-9(2,3)6-8(7)10/h4-5,7H,6H2,1-3H3
InChIKey IVSKDXCSHZLVON-UHFFFAOYSA-N
Molecular Weight 138.210 g/mol
SMILES C1(=O)C(C=CC(C1)(C)C)C
SPLASH splash10-000t-9000000000-0f6b883422a8a4a09f03
Synonyms 3-Cyclohexen-1-one, 2,5,5-trimethyl- 2,5,5-trimethyl-1-cyclohex-3-enone 2,5,5-Trimethyl-3-cyclohexen-1-one 2,5,5-trimethylcyclohex-3-en-1-one
Wiley ID 1481427