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(+)-(1'S,3'S,6'S,E)-4-(2',2',3',6'-TETRAMETHYLCYCLOHEXYL)-BUT-3-EN-2-ONE
SpectraBase Compound ID CKaWxC5yHp3
InChI InChI=1S/C14H24O/c1-10-6-7-11(2)14(4,5)13(10)9-8-12(3)15/h8-11,13H,6-7H2,1-5H3/b9-8+/t10-,11-,13+/m0/s1
InChIKey ZNWOKRUGFTXKDK-GWXODXNXSA-N
Mol Weight 208.34 g/mol
Molecular Formula C14H24O
Exact Mass 208.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LlMwgXWEMtx
Name (1'S,3'S,6'S,E)-4-(2',2',3',6-Tetramethylcyclohexyl)but-3-en-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H24O
InChI InChI=1S/C14H24O/c1-10-6-7-11(2)14(4,5)13(10)9-8-12(3)15/h8-11,13H,6-7H2,1-5H3/b9-8+/t10-,11-,13+/m0/s1
InChIKey ZNWOKRUGFTXKDK-GWXODXNXSA-N
Molecular Weight 208.345 g/mol
SMILES C1([C@](\C=C\C(=O)C)([C@@](C)(CC[C@@]1(C)[H])[H])[H])(C)C
SPLASH splash10-0bu4-9800000000-72d6b885614aea6342d2
Source of Spectrum H-76-2085-21
Synonyms (3E)-4-[(1S,3S,6S)-2,2,3,6-tetramethylcyclohexyl]-3-buten-2-one
Wiley ID 1207603