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Methyl propionate, 2-[octahydro-3a',7a'-dimethyl-4',7'-methano-1'H-inden-1'-yl-(1'alpha,3a'alpha,4'beta,7'beta,7a'alpha)]-(2R)
SpectraBase Compound ID EWdKfkyYaY9
InChI InChI=1S/C16H26O2/c1-10(14(17)18-4)13-7-8-15(2)11-5-6-12(9-11)16(13,15)3/h10-13H,5-9H2,1-4H3/t10-,11+,12-,13-,15-,16-/m1/s1
InChIKey OTRCUSXBJAAHBZ-QIDIWCQUSA-N
Mol Weight 250.38 g/mol
Molecular Formula C16H26O2
Exact Mass 250.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A1sLhD38Nwt
Name Methyl propionate, 2-[octahydro-3a',7a'-dimethyl-4',7'-methano-1'H-inden-1'-yl-(1'alpha,3a'alpha,4'beta,7'beta,7a'alpha)]-(2R)
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Formula C16H26O2
InChI InChI=1S/C16H26O2/c1-10(14(17)18-4)13-7-8-15(2)11-5-6-12(9-11)16(13,15)3/h10-13H,5-9H2,1-4H3/t10-,11+,12-,13-,15-,16-/m1/s1
InChIKey OTRCUSXBJAAHBZ-QIDIWCQUSA-N
Literature Reference DOI 10.1002/ffj.2730100315
Molecular Weight 250.382 g/mol
SMILES [C@@]12([C@]3(CC[C@@]([C@@]2([C@@]([C@@](C)(C(=O)OC)[H])(CC1)[H])C)(C3)[H])[H])C
SPLASH splash10-00e9-5900000000-99ae098a7506e0dbb245
Source of Spectrum FF-10-214-5
Synonyms Cyclosantalic acid methyl ester Methyl (R)-2-((1R,3aR,4S,7R,7aR)-3a,7a-dimethyloctahydro-1H-4,7-methanoinden-1-yl)propanoate
Wiley ID 1801307