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[1R*,2S*]-1-acetyl-1,2-(isopropylidenedioxy)-3-cyclohexene
SpectraBase Compound ID I3RSeXsMWzn
InChI InChI=1S/C11H16O3/c1-8(12)11-7-5-4-6-9(11)13-10(2,3)14-11/h4,6,9H,5,7H2,1-3H3/t9-,11-/m0/s1
InChIKey YTVACISREYBUPQ-ONGXEEELSA-N
Mol Weight 196.25 g/mol
Molecular Formula C11H16O3
Exact Mass 196.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID eHUXsXlNrE
Name [1R*,2S*]-1-acetyl-1,2-(isopropylidenedioxy)-3-cyclohexene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O3
InChI InChI=1S/C11H16O3/c1-8(12)11-7-5-4-6-9(11)13-10(2,3)14-11/h4,6,9H,5,7H2,1-3H3/t9-,11-/m0/s1
InChIKey YTVACISREYBUPQ-ONGXEEELSA-N
Molecular Weight 196.246 g/mol
SMILES [C@]12(OC(C)(C)O[C@]2(C=CCC1)[H])C(=O)C
SPLASH splash10-0002-9200000000-4cb1cdeb7a26146cfe4d
Source of Spectrum J-55-1034-25
Synonyms 1-((3aR,7aS)-2,2-dimethyl-5,7a-dihydro-1,3-benzodioxol-3a(4H)-yl)ethanone
Wiley ID 1193189