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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)

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 JghZjO3qYQN
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
InChIKey HSOPBTCGSYKCGY-ITTXBHIMSA-N
Mol Weight 254.37 g/mol
Molecular Formula C15H26O3
Exact Mass 254.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E0iYEc7KCnJ
Name 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 C15H26O3
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
InChIKey HSOPBTCGSYKCGY-ITTXBHIMSA-N
Molecular Weight 254.370 g/mol
SMILES OC([C@@]([C@]1([C@]2(C[C@@](CC[C@]2([C@@](CC1)(C)[H])[H])(O)C)[H])[H])(C)[H])=O
SPLASH splash10-03di-0910000000-211716980015dd36251f
Source of Spectrum KC-60-1132-5
Synonyms (2R)-2-[(1R,4R,4aS,7R,8aS)-7-hydroxy-4,7-dimethyl-2,3,4,4a,5,6,8,8a-octahydro-1H-naphthalen-1-yl]propanoic acid (2R)-2-[(1R,4R,4aS,7R,8aS)-7-hydroxy-4,7-dimethyl-decalin-1-yl]propanoic acid (2R)-2-[(1R,4R,4aS,7R,8aS)-4,7-dimethyl-7-oxidanyl-2,3,4,4a,5,6,8,8a-octahydro-1H-naphthalen-1-yl]propanoic acid
Wiley ID 1583226