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(3S)-5-[(1R,2R,4aS,8aS)-2-acetoxy-2,5,5,8a-tetramethyl-decalin-1-yl]-3-methyl-pentanoic acid
SpectraBase Compound ID 5Jfj4rr48JK
InChI InChI=1S/C22H38O4/c1-15(14-19(24)25)8-9-18-21(5)12-7-11-20(3,4)17(21)10-13-22(18,6)26-16(2)23/h15,17-18H,7-14H2,1-6H3,(H,24,25)/t15-,17-,18+,21-,22+/m0/s1
InChIKey UUVHOZKAPKYWRN-CNFPBCLWSA-N
Mol Weight 366.5 g/mol
Molecular Formula C22H38O4
Exact Mass 366.27701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bfq5xBSUXoC
Name (3S)-5-[(1R,2R,4aS,8aS)-2-acetoxy-2,5,5,8a-tetramethyl-decalin-1-yl]-3-methyl-pentanoic acid
Alternate Name(s) (3S)-5-[(1R,2R,4aS,8aS)-2-acetoxy-2,5,5,8a-tetramethyl-decalin-1-yl]-3-methyl-valeric acid (3S)-5-[(1R,2R,4aS,8aS)-2-acetyloxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methyl-pentanoic acid
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Formula C22H38O4
InChI InChI=1S/C22H38O4/c1-15(14-19(24)25)8-9-18-21(5)12-7-11-20(3,4)17(21)10-13-22(18,6)26-16(2)23/h15,17-18H,7-14H2,1-6H3,(H,24,25)/t15-,17-,18+,21-,22+/m0/s1
InChIKey UUVHOZKAPKYWRN-CNFPBCLWSA-N
Molecular Weight 366.542 g/mol
SMILES OC(C[C@](CC[C@]1([C@](CC[C@]2(C(CCC[C@]12C)(C)C)[H])(C)OC(=O)C)[H])(C)[H])=O
SPLASH splash10-0a4l-2924000000-591a793987b4d1c27ee5
Source of Spectrum KC-57-5660-2
Wiley ID 1624788