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1-Naphthalenecarboxylic acid, decahydro-1,4a-dimethyl-6-methylene-5-(3-methyl-5-oxohexyl)-, methyl ester, [1S-[1.alpha.,4a.alpha.,5.alpha.(R*),8a.alpha.]]-
SpectraBase Compound ID 6InEceiCruy
InChI InChI=1S/C22H36O3/c1-15(14-17(3)23)8-10-18-16(2)9-11-19-21(18,4)12-7-13-22(19,5)20(24)25-6/h15,18-19H,2,7-14H2,1,3-6H3
InChIKey BXFIQIHHUYQVJG-UHFFFAOYSA-N
Mol Weight 348.5 g/mol
Molecular Formula C22H36O3
Exact Mass 348.266445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FIN8msM9v5a
Name 1-Naphthalenecarboxylic acid, decahydro-1,4a-dimethyl-6-methylene-5-(3-methyl-5-oxohexyl)-, methyl ester, [1S-[1.alpha.,4a.alpha.,5.alpha.(R*),8a.alpha.]]-
Alternate Name(s) Methyl 1,4a-dimethyl-6-methylene-5-(3-methyl-5-oxohexyl)decahydro-1-naphthalenecarboxylate 1,4a-dimethyl-6-methylene-5-(3-methyl-5-oxohexyl)-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid methyl ester 5-(5-keto-3-methyl-hexyl)-1,4a-dimethyl-6-methylene-decalin-1-carboxylic acid methyl ester Methyl 1,4a-dimethyl-6-methylene-5-(3-methyl-5-oxo-hexyl)decalin-1-carboxylate Methyl 1,4a-dimethyl-6-methylidene-5-(3-methyl-5-oxidanylidene-hexyl)-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylate Methyl 1,4a-dimethyl-6-methylidene-5-(3-methyl-5-oxohexyl)-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylate
CAS Registry Number 55515-21-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H36O3
InChI InChI=1S/C22H36O3/c1-15(14-17(3)23)8-10-18-16(2)9-11-19-21(18,4)12-7-13-22(19,5)20(24)25-6/h15,18-19H,2,7-14H2,1,3-6H3
InChIKey BXFIQIHHUYQVJG-UHFFFAOYSA-N
Molecular Weight 348.527 g/mol
SMILES C12(C)C(C(C(OC)=O)(C)CCC2)CCC(C1CCC(CC(C)=O)C)=C
SPLASH splash10-05g0-3920000000-4f97324bf010dff89858
Source of Spectrum AD-0-5307-0
Wiley ID 51750