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(Z)-2-Methylbut-2-enoic acid (1R,2R,4aR,7R,8aR)-1-hydroxy-7-isopropyl-1,4a-dimethyl-6-oxodecahydronaphthalen-2-yl ester

View entire compound with spectra: 1 MS (GC)

(Z)-2-Methylbut-2-enoic acid (1R,2R,4aR,7R,8aR)-1-hydroxy-7-isopropyl-1,4a-dimethyl-6-oxodecahydronaphthalen-2-yl ester
SpectraBase Compound ID 3ZiPwMjC7oT
InChI InChI=1S/C20H32O4/c1-7-13(4)18(22)24-17-8-9-19(5)11-15(21)14(12(2)3)10-16(19)20(17,6)23/h7,12,14,16-17,23H,8-11H2,1-6H3/b13-7-/t14-,16-,17-,19-,20-/m1/s1
InChIKey LZCAMMRMUKFTQK-QEZSIMIHSA-N
Mol Weight 336.5 g/mol
Molecular Formula C20H32O4
Exact Mass 336.23006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JEtiMpCLXal
Name (Z)-2-Methylbut-2-enoic acid (1R,2R,4aR,7R,8aR)-1-hydroxy-7-isopropyl-1,4a-dimethyl-6-oxodecahydronaphthalen-2-yl ester
Alternate Name(s) (1R,2R,4aR,7R,8aR)-1-hydroxy-7-isopropyl-1,4a-dimethyl-6-oxodecahydro-2-naphthalenyl (2Z)-2-methyl-2-butenoate (Z)-2-methyl-2-butenoic acid[(1R,2R,4aR,7R,8aR)-1-hydroxy-1,4a-dimethyl-6-oxo-7-propan-2-yl-3,4,5,7,8,8a-hexahydro-2H-naphthalen-2-yl]ester (Z)-2-methylbut-2-enoic acid[(1R,2R,4aR,7R,8aR)-1-hydroxy-7-isopropyl-6-keto-1,4a-dimethyl-decalin-2-yl]ester [(1R,2R,4aR,7R,8aR)-1,4a-dimethyl-1-oxidanyl-6-oxidanylidene-7-propan-2-yl-3,4,5,7,8,8a-hexahydro-2H-naphthalen-2-yl](Z)-2-methylbut-2-enoate [(1R,2R,4aR,7R,8aR)-1-hydroxy-1,4a-dimethyl-6-oxo-7-propan-2-yl-3,4,5,7,8,8a-hexahydro-2H-naphthalen-2-yl](Z)-2-methylbut-2-enoate [(1R,2R,4aR,7R,8aR)-1-hydroxy-7-isopropyl-1,4a-dimethyl-6-oxo-decalin-2-yl](Z)-2-methylbut-2-enoate (Z)-2-methyl-2-butenoic acid [(1R,2R,4aR,7R,8aR)-1-hydroxy-1,4a-dimethyl-6-oxo-7-propan-2-yl-3,4,5,7,8,8a-hexahydro-2H-naphthalen-2-yl] ester [(1R,2R,4aR,7R,8aR)-1-hydroxy-1,4a-dimethyl-6-oxo-7-propan-2-yl-3,4,5,7,8,8a-hexahydro-2H-naphthalen-2-yl] (Z)-2-methylbut-2-enoate [(1R,2R,4aR,7R,8aR)-1-hydroxy-7-isopropyl-1,4a-dimethyl-6-oxo-decalin-2-yl] (Z)-2-methylbut-2-enoate [(1R,2R,4aR,7R,8aR)-1,4a-dimethyl-1-oxidanyl-6-oxidanylidene-7-propan-2-yl-3,4,5,7,8,8a-hexahydro-2H-naphthalen-2-yl] (Z)-2-methylbut-2-enoate
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Formula C20H32O4
InChI InChI=1S/C20H32O4/c1-7-13(4)18(22)24-17-8-9-19(5)11-15(21)14(12(2)3)10-16(19)20(17,6)23/h7,12,14,16-17,23H,8-11H2,1-6H3/b13-7-/t14-,16-,17-,19-,20-/m1/s1
InChIKey LZCAMMRMUKFTQK-QEZSIMIHSA-N
Molecular Weight 336.472 g/mol
SMILES O[C@]1([C@](OC(\C(=C/C)C)=O)(CC[C@@]2(CC([C@](C[C@@]12[H])(C(C)C)[H])=O)C)[H])C
SPLASH splash10-001i-9200000000-4923ed2878130786a76e
Source of Spectrum KC-0-734-0
Wiley ID 830094