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(S)-Ethyl 3-methyl-5-((1S,4as,8as)-2,5,5,8A-tetramethyl-1,4,4A,5,6,7,8,8A-octahydronaphthalen-1-yl)pentanoate
SpectraBase Compound ID 7bTMGJwVYXg
InChI InChI=1S/C22H38O2/c1-7-24-20(23)15-16(2)9-11-18-17(3)10-12-19-21(4,5)13-8-14-22(18,19)6/h10,16,18-19H,7-9,11-15H2,1-6H3/t16-,18-,19-,22-/m0/s1
InChIKey YYDZORCXDQFCAQ-FUOQNJDISA-N
Mol Weight 334.5 g/mol
Molecular Formula C22H38O2
Exact Mass 334.28718 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ep1UkG0TBSj
Name (S)-Ethyl 3-methyl-5-((1S,4as,8as)-2,5,5,8A-tetramethyl-1,4,4A,5,6,7,8,8A-octahydronaphthalen-1-yl)pentanoate
Comments Computed using HOSE algorithm
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Exact Mass 334.287180462 u
Formula C22H38O2
InChI InChI=1S/C22H38O2/c1-7-24-20(23)15-16(2)9-11-18-17(3)10-12-19-21(4,5)13-8-14-22(18,19)6/h10,16,18-19H,7-9,11-15H2,1-6H3/t16-,18-,19-,22-/m0/s1
InChIKey YYDZORCXDQFCAQ-FUOQNJDISA-N
Molecular Weight 334.544 g/mol
SMILES [C@]1(C(=CC[C@@]2([C@]1(CCCC2(C)C)C)[H])C)(CC[C@@](CC(=O)OCC)(C)[H])[H]