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1-Cyclohexene-1-propanoic acid, 3-[1-(acetyloxy)-1-methylethyl]-6-methyl-, methyl ester, (3S-cis)-
SpectraBase Compound ID KaLmENH6Mx8
InChI InChI=1S/C16H26O4/c1-11-6-8-14(16(3,4)20-12(2)17)10-13(11)7-9-15(18)19-5/h10-11,14H,6-9H2,1-5H3/t11-,14+/m1/s1
InChIKey ABPBJDLVVTWWPP-RISCZKNCSA-N
Mol Weight 282.38 g/mol
Molecular Formula C16H26O4
Exact Mass 282.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L2E5HuO59ML
Name 1-Cyclohexene-1-propanoic acid, 3-[1-(acetyloxy)-1-methylethyl]-6-methyl-, methyl ester, (3S-cis)-
CAS Registry Number 77284-04-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H26O4
InChI InChI=1S/C16H26O4/c1-11-6-8-14(16(3,4)20-12(2)17)10-13(11)7-9-15(18)19-5/h10-11,14H,6-9H2,1-5H3/t11-,14+/m1/s1
InChIKey ABPBJDLVVTWWPP-RISCZKNCSA-N
Molecular Weight 282.380 g/mol
SMILES C1=C([C@](C)(CC[C@@]1(C(OC(=O)C)(C)C)[H])[H])CCC(=O)OC
SPLASH splash10-006x-8940000000-96ba362cb0770924875d
Source of Spectrum KQ-1984-220-0
Synonyms (1R,4S)-8-Acetoxy-2-(2-methoxycarbonylethyl)-p-menth-2-ene Methyl 3-{(3S,6R)-3-[1-(acetyloxy)-1-methylethyl]-6-methyl-1-cyclohexen-1-yl}propanoate
Wiley ID 1285949