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1-[(1S,2R)-1,2-dimethyl-4-(4-methylpent-3-enyl)-1-cyclohex-3-enyl]ethanone
SpectraBase Compound ID 4h85RMywS2s
InChI InChI=1S/C16H26O/c1-12(2)7-6-8-15-9-10-16(5,14(4)17)13(3)11-15/h7,11,13H,6,8-10H2,1-5H3/t13-,16+/m1/s1
InChIKey WVXAQUSBMRDRSY-CJNGLKHVSA-N
Mol Weight 234.38 g/mol
Molecular Formula C16H26O
Exact Mass 234.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4ykDevLGcJl
Name 1-[(1S,2R)-1,2-dimethyl-4-(4-methylpent-3-enyl)-1-cyclohex-3-enyl]ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H26O
InChI InChI=1S/C16H26O/c1-12(2)7-6-8-15-9-10-16(5,14(4)17)13(3)11-15/h7,11,13H,6,8-10H2,1-5H3/t13-,16+/m1/s1
InChIKey WVXAQUSBMRDRSY-CJNGLKHVSA-N
Molecular Weight 234.383 g/mol
SMILES [C@@]1([C@@](C=C(CC1)CCC=C(C)C)(C)[H])(C(=O)C)C
SPLASH splash10-0a4i-0900000000-94ce9bae2515b19bb76f
Source of Spectrum KD-15-3970-3
Synonyms 1-[(1S,2R)-1,2-dimethyl-4-(4-methylpent-3-enyl)cyclohex-3-en-1-yl]ethanone
Wiley ID 1637361