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3-[(1S,2S,4aR,6S,8aS)-2,6-dimethyl-6-oxidanyl-2,4a,5,7,8,8a-hexahydro-1H-naphthalen-1-yl]propanoic acid
SpectraBase Compound ID 2K7BSPJLMr6
InChI InChI=1S/C15H24O3/c1-10-3-4-11-9-15(2,18)8-7-13(11)12(10)5-6-14(16)17/h3-4,10-13,18H,5-9H2,1-2H3,(H,16,17)/t10-,11-,12-,13-,15-/m0/s1
InChIKey JCBGMXDVXDFMAS-CXOVXGEYSA-N
Mol Weight 252.35 g/mol
Molecular Formula C15H24O3
Exact Mass 252.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E8cMPAvuqoI
Name 3-[(1S,2S,4aR,6S,8aS)-2,6-dimethyl-6-oxidanyl-2,4a,5,7,8,8a-hexahydro-1H-naphthalen-1-yl]propanoic acid
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Formula C15H24O3
InChI InChI=1S/C15H24O3/c1-10-3-4-11-9-15(2,18)8-7-13(11)12(10)5-6-14(16)17/h3-4,10-13,18H,5-9H2,1-2H3,(H,16,17)/t10-,11-,12-,13-,15-/m0/s1
InChIKey JCBGMXDVXDFMAS-CXOVXGEYSA-N
Molecular Weight 252.354 g/mol
SMILES OC(CC[C@]1([C@](C=C[C@@]2([C@@]1(CC[C@@](C2)(O)C)[H])[H])(C)[H])[H])=O
SPLASH splash10-0900-0900000000-7e86fe0f4384aefcb5a0
Source of Spectrum J-1-58-20
Synonyms 3-[(1S,2S,4aR,6S,8aS)-6-hydroxy-2,6-dimethyl-2,4a,5,7,8,8a-hexahydro-1H-naphthalen-1-yl]propanoic acid 3-[(1S,2S,4aR,6S,8aS)-6-hydroxy-2,6-dimethyl-2,4a,5,7,8,8a-hexahydro-1H-naphthalen-1-yl]propionic acid
Wiley ID 1577558