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3-Hexanone, 1-(2,5,6,6-tetramethyl-2-cyclohexen-1-yl)-, cis-
SpectraBase Compound ID JCaPk17ROM6
InChI InChI=1S/C16H28O/c1-6-7-14(17)10-11-15-12(2)8-9-13(3)16(15,4)5/h8,13,15H,6-7,9-11H2,1-5H3/t13-,15+/m1/s1
InChIKey OGYYOPBGFGYHJO-HIFRSBDPSA-N
Mol Weight 236.4 g/mol
Molecular Formula C16H28O
Exact Mass 236.214016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1zzFgdc4ac
Name 3-Hexanone, 1-(2,5,6,6-tetramethyl-2-cyclohexen-1-yl)-, cis-
CAS Registry Number 106201-56-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H28O
InChI InChI=1S/C16H28O/c1-6-7-14(17)10-11-15-12(2)8-9-13(3)16(15,4)5/h8,13,15H,6-7,9-11H2,1-5H3/t13-,15+/m1/s1
InChIKey OGYYOPBGFGYHJO-HIFRSBDPSA-N
Molecular Weight 236.399 g/mol
SMILES C1([C@](C(C)=CC[C@]1(C)[H])(CCC(=O)CCC)[H])(C)C
SPLASH splash10-00du-9800000000-fe5f289cbe35c1cbf5ac
Source of Spectrum H-68-1973-70
Synonyms 1-(cis-2,5,6,6-tetramethyl-2-cyclohexenyl)-3-hexanone 1-[(1S,5R)-2,5,6,6-tetramethyl-2-cyclohexen-1-yl]-3-hexanone
Wiley ID 1239024