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(R)-methyl 3-methyl-5-((1S,4aR,8aR)-2,5,5,8a-tetramethyl-6-oxo-1,4,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)pentanoate
SpectraBase Compound ID 1fCCvpxLsaH
InChI InChI=1S/C21H34O3/c1-14(13-19(23)24-6)7-9-16-15(2)8-10-17-20(3,4)18(22)11-12-21(16,17)5/h8,14,16-17H,7,9-13H2,1-6H3/t14-,16+,17+,21-/m1/s1
InChIKey WONSMFXLYXZLQI-PCPGWFQFSA-N
Mol Weight 334.5 g/mol
Molecular Formula C21H34O3
Exact Mass 334.250795 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BAWO4cqCerk
Name (R)-methyl 3-methyl-5-((1S,4aR,8aR)-2,5,5,8a-tetramethyl-6-oxo-1,4,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)pentanoate
Alternate Name(s) Methyl (R)-3-methyl-5-((1S,4aR,8aR)-2,5,5,8a-tetramethyl-6-oxo-1,4,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)pentanoate
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Formula C21H34O3
InChI InChI=1S/C21H34O3/c1-14(13-19(23)24-6)7-9-16-15(2)8-10-17-20(3,4)18(22)11-12-21(16,17)5/h8,14,16-17H,7,9-13H2,1-6H3/t14-,16+,17+,21-/m1/s1
InChIKey WONSMFXLYXZLQI-PCPGWFQFSA-N
Literature Reference DOI 10.1002/cber.19761090428
Molecular Weight 334.500 g/mol
SMILES [C@@]12([C@](C(C)(C)C(=O)CC2)(CC=C([C@@]1(CC[C@](CC(OC)=O)(C)[H])[H])C)[H])C
SPLASH splash10-00dj-0896000000-6b84bb9b8b1583e9f5e2
Source of Spectrum K-109-1444-4
Wiley ID 1794088