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cis-Ethyl 3-[2-Allyl-3-oxocyclohexyl]propanoate
SpectraBase Compound ID EFplIlBGpG8
InChI InChI=1S/C14H22O3/c1-3-6-12-11(7-5-8-13(12)15)9-10-14(16)17-4-2/h3,11-12H,1,4-10H2,2H3/t11-,12+/m0/s1
InChIKey BIVXFULHONJLLQ-NWDGAFQWSA-N
Mol Weight 238.33 g/mol
Molecular Formula C14H22O3
Exact Mass 238.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7sgwO6cf0hZ
Name cis-Ethyl 3-[2-Allyl-3-oxocyclohexyl]propanoate
Alternate Name(s) Ethyl 3-[(1S,2R)-2-allyl-3-oxocyclohexyl]propanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O3
InChI InChI=1S/C14H22O3/c1-3-6-12-11(7-5-8-13(12)15)9-10-14(16)17-4-2/h3,11-12H,1,4-10H2,2H3/t11-,12+/m0/s1
InChIKey BIVXFULHONJLLQ-NWDGAFQWSA-N
Molecular Weight 238.327 g/mol
SMILES C1([C@@]([C@](CCC(=O)OCC)(CCC1)[H])(CC=C)[H])=O
SPLASH splash10-053j-9700000000-3809049385b9b5f21d11
Source of Spectrum J-61-6437-12
Wiley ID 1240892