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[2S-(1E,2.alpha.,3.beta.,5.alpha.)]-[2,3-bis(acetyloxy)-2-methyl-5-(1-methylethenyl)cyclohexylidene]acene]acetic acid ethyl ester
SpectraBase Compound ID jLcpuRap6d
InChI InChI=1S/C18H26O6/c1-7-22-17(21)10-15-8-14(11(2)3)9-16(23-12(4)19)18(15,6)24-13(5)20/h10,14,16H,2,7-9H2,1,3-6H3/b15-10+/t14-,16+,18-/m1/s1
InChIKey XXEZXKDQLYYZQN-XJNFEHDRSA-N
Mol Weight 338.4 g/mol
Molecular Formula C18H26O6
Exact Mass 338.172939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lp2UF9KoPbG
Name [2S-(1E,2.alpha.,3.beta.,5.alpha.)]-[2,3-bis(acetyloxy)-2-methyl-5-(1-methylethenyl)cyclohexylidene]acene]acetic acid ethyl ester
Alternate Name(s) Ethyl (2E)-[(2R,3S,5R)-2,3-bis(acetyloxy)-5-isopropenyl-2-methylcyclohexylidene]ethanoate
CAS Registry Number 81506-18-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26O6
InChI InChI=1S/C18H26O6/c1-7-22-17(21)10-15-8-14(11(2)3)9-16(23-12(4)19)18(15,6)24-13(5)20/h10,14,16H,2,7-9H2,1,3-6H3/b15-10+/t14-,16+,18-/m1/s1
InChIKey XXEZXKDQLYYZQN-XJNFEHDRSA-N
Molecular Weight 338.400 g/mol
SMILES [C@]1(\C(C[C@](C[C@@]1(OC(=O)C)[H])(C(=C)C)[H])=C\C(=O)OCC)(OC(=O)C)C
SPLASH splash10-0006-9130000000-876a27121d4668df5602
Source of Spectrum J-51-3103-17
Wiley ID 1333664