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[15-C2H3]-2-(7.alpha.-Hydroxy-4,7-dimethyl-(1.alpha.H),2,3,(4.beta.H),(4a.alpha..H),5,6,7,8,(8a.alpha.H)-decahydronaphthalen-1-yl)propionic acid

View entire compound with spectra: 1 MS (GC)

[15-C2H3]-2-(7.alpha.-Hydroxy-4,7-dimethyl-(1.alpha.H),2,3,(4.beta.H),(4a.alpha..H),5,6,7,8,(8a.alpha.H)-decahydronaphthalen-1-yl)propionic acid
SpectraBase Compound ID L6FtAtQBxoI
InChI InChI=1S/C15H26O3/c1-9-4-5-12(10(2)14(16)17)13-8-15(3,18)7-6-11(9)13/h9-13,18H,4-8H2,1-3H3,(H,16,17)/t9-,10-,11+,12+,13+,15-/m1/s1/i3D3
InChIKey HSOPBTCGSYKCGY-QNPQKOSSSA-N
Mol Weight 257.39 g/mol
Molecular Formula C15H232D3O3
Exact Mass 257.207025 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GXvfVfhEtJF
Name [15-C2H3]-2-(7.alpha.-Hydroxy-4,7-dimethyl-(1.alpha.H),2,3,(4.beta.H),(4a.alpha..H),5,6,7,8,(8a.alpha.H)-decahydronaphthalen-1-yl)propionic acid
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Formula C15H23D3O3
InChI InChI=1S/C15H26O3/c1-9-4-5-12(10(2)14(16)17)13-8-15(3,18)7-6-11(9)13/h9-13,18H,4-8H2,1-3H3,(H,16,17)/t9-,10-,11+,12+,13+,15-/m1/s1/i3D3
InChIKey HSOPBTCGSYKCGY-QNPQKOSSSA-N
Molecular Weight 257.388 g/mol
SMILES OC([C@@]([C@]1([C@]2(C[C@@](CC[C@]2([C@@](CC1)(C)[H])[H])(O)C([2D])([2D])[2D])[H])[H])(C)[H])=O
SPLASH splash10-014i-0910000000-cf1a422a9486d485e84b
Source of Spectrum KC-60-1133-5
Wiley ID 1583221