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(3E)-4-[trans-2',4',4',5'-tetramethylcyclohex-2'-en-1'-yl]but-3-en-2-one
SpectraBase Compound ID 6y7jc4NeGb2
InChI InChI=1S/C14H22O/c1-10-9-14(4,5)11(2)8-13(10)7-6-12(3)15/h6-7,9,11,13H,8H2,1-5H3/b7-6+/t11-,13-/m1/s1
InChIKey OILAGUOERDBOCN-BKVNPXPRSA-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 5C7BlTi24o0
Name (3E)-4-[trans-2',4',4',5'-tetramethylcyclohex-2'-en-1'-yl]but-3-en-2-one
Alternate Name(s) (3E)-4-[(1S,5R)-2,4,4,5-tetramethyl-2-cyclohexen-1-yl]-3-buten-2-one
CAS Registry Number 127128-57-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O
InChI InChI=1S/C14H22O/c1-10-9-14(4,5)11(2)8-13(10)7-6-12(3)15/h6-7,9,11,13H,8H2,1-5H3/b7-6+/t11-,13-/m1/s1
InChIKey OILAGUOERDBOCN-BKVNPXPRSA-N
Molecular Weight 206.329 g/mol
SMILES C1=C([C@](\C=C\C(=O)C)(C[C@](C1(C)C)(C)[H])[H])C
SPLASH splash10-0006-9800000000-6e1bd37634a15cfaf818
Source of Spectrum H-72-1519-5
Wiley ID 1205199