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Cyclohexanepropanoic acid, 3-(acetyloxy)-2,2-dimethyl-6-methylene-, methyl ester, (1S-trans)-
SpectraBase Compound ID 28bNyOP5icm
InChI InChI=1S/C15H24O4/c1-10-6-8-13(19-11(2)16)15(3,4)12(10)7-9-14(17)18-5/h12-13H,1,6-9H2,2-5H3/t12-,13-/m0/s1
InChIKey UKOORXHXVFBHRR-STQMWFEESA-N
Mol Weight 268.35 g/mol
Molecular Formula C15H24O4
Exact Mass 268.167459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GRTac42sKHy
Name Cyclohexanepropanoic acid, 3-(acetyloxy)-2,2-dimethyl-6-methylene-, methyl ester, (1S-trans)-
CAS Registry Number 79400-53-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24O4
InChI InChI=1S/C15H24O4/c1-10-6-8-13(19-11(2)16)15(3,4)12(10)7-9-14(17)18-5/h12-13H,1,6-9H2,2-5H3/t12-,13-/m0/s1
InChIKey UKOORXHXVFBHRR-STQMWFEESA-N
Molecular Weight 268.353 g/mol
SMILES C1([C@](C(=C)CC[C@@]1(OC(=O)C)[H])(CCC(=O)OC)[H])(C)C
SPLASH splash10-01bc-9400000000-4076a8c7d15ffe81084f
Source of Spectrum H-64-950-0
Synonyms (+)-(1'S,3'S)-Methyl 3-(3'-acetoxy-2',2'-dimethyl-6'-methylidenecyclohexyl)propionate Methyl 3-[(1S,3S)-3-(acetyloxy)-2,2-dimethyl-6-methylenecyclohexyl]propanoate
Wiley ID 1272159