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(E)-3-(2,6,6-trimethyl-1-cyclohex-2-enyl)-2-propenal
SpectraBase Compound ID DAUxVQzOiMJ
InChI InChI=1S/C12H18O/c1-10-6-4-8-12(2,3)11(10)7-5-9-13/h5-7,9,11H,4,8H2,1-3H3/b7-5+
InChIKey UJVSEMXLKPHRHD-FNORWQNLSA-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 5T58UTk6K1W
Name (E)-3-(2,6,6-trimethyl-1-cyclohex-2-enyl)-2-propenal
CAS Registry Number 29460-68-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O
InChI InChI=1S/C12H18O/c1-10-6-4-8-12(2,3)11(10)7-5-9-13/h5-7,9,11H,4,8H2,1-3H3/b7-5+
InChIKey UJVSEMXLKPHRHD-FNORWQNLSA-N
Molecular Weight 178.275 g/mol
SMILES C1(C(=CCCC1(C)C)C)\C=C\C=O
SPLASH splash10-05bf-9600000000-8148f6524533956075b4
Source of Spectrum H-56-2504-20
Synonyms (E)-3-(2,6,6-trimethylcyclohex-2-en-1-yl)acrolein (E)-3-(2,6,6-trimethylcyclohex-2-en-1-yl)prop-2-enal
Wiley ID 1174587