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Shyobunyl-acetate
SpectraBase Compound ID A53qpt6aeys
InChI InChI=1S/C17H28O2/c1-8-17(7)10-9-14(11(2)3)16(19-13(6)18)15(17)12(4)5/h8,11,14-16H,1,4,9-10H2,2-3,5-7H3/t14-,15+,16+,17+/m0/s1
InChIKey YDQZSIGUGOIRSL-YLFCFFPRSA-N
Mol Weight 264.41 g/mol
Molecular Formula C17H28O2
Exact Mass 264.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 98aw23BBSK1
Name Shyobunyl-acetate
Alternate Name(s) (1R,2S,3S,6S)-6-isopropyl-3-methyl-2-(prop-1-en-2-yl)-3-vinylcyclohexyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H28O2
InChI InChI=1S/C17H28O2/c1-8-17(7)10-9-14(11(2)3)16(19-13(6)18)15(17)12(4)5/h8,11,14-16H,1,4,9-10H2,2-3,5-7H3/t14-,15+,16+,17+/m0/s1
InChIKey YDQZSIGUGOIRSL-YLFCFFPRSA-N
Literature Reference DOI 10.1002/hlca.19780610736
Molecular Weight 264.409 g/mol
SMILES [C@]1([C@@]([C@@]([C@@](CC1)(C(C)C)[H])(OC(C)=O)[H])(C(C)=C)[H])(C=C)C
SPLASH splash10-002f-6900000000-741d4266874b27ea4efd
Source of Spectrum H-61-2679-26
Wiley ID 1797404