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[15-C2H3]-2-(4,7-Dimethyl-(1.alpha.H),2,3,(4.beta.H),(4a.alpha..H),5,8,(8a.beta.H)-octahydronaphthalen-1-yl)propionic acid
SpectraBase Compound ID HjNEUkJfY4n
InChI InChI=1S/C15H24O2/c1-9-4-6-12-10(2)5-7-13(14(12)8-9)11(3)15(16)17/h4,10-14H,5-8H2,1-3H3,(H,16,17)/t10-,11-,12+,13+,14+/m1/s1/i1D3
InChIKey WJCXZVOSTWVSLP-KWTKAIMQSA-N
Mol Weight 239.37 g/mol
Molecular Formula C15H212D3O2
Exact Mass 239.19646 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BeUXF9TTqRA
Name [15-C2H3]-2-(4,7-Dimethyl-(1.alpha.H),2,3,(4.beta.H),(4a.alpha..H),5,8,(8a.beta.H)-octahydronaphthalen-1-yl)propionic acid
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Formula C15H21D3O2
InChI InChI=1S/C15H24O2/c1-9-4-6-12-10(2)5-7-13(14(12)8-9)11(3)15(16)17/h4,10-14H,5-8H2,1-3H3,(H,16,17)/t10-,11-,12+,13+,14+/m1/s1/i1D3
InChIKey WJCXZVOSTWVSLP-KWTKAIMQSA-N
Molecular Weight 239.373 g/mol
SMILES OC([C@@]([C@]1([C@@]2([C@@](CC=C(C2)C([2D])([2D])[2D])([C@@](CC1)(C)[H])[H])[H])[H])(C)[H])=O
SPLASH splash10-014i-0900000000-04ecdf9fc1bf099633fd
Source of Spectrum KC-60-1134-9
Wiley ID 1583216