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1.alpha.-(hydroxymethyl)-7.alpha.,8.alpha.-dimethyl-7-(2-(3-furyl)ethyl)bicyclo[4.4.0]dec-2-ene-2-carboxylic acid
SpectraBase Compound ID 1BBi9FnGqjx
InChI InChI=1S/C20H28O4/c1-14-6-10-20(13-21)16(18(22)23)4-3-5-17(20)19(14,2)9-7-15-8-11-24-12-15/h4,8,11-12,14,17,21H,3,5-7,9-10,13H2,1-2H3,(H,22,23)/t14-,17?,19+,20-/m1/s1
InChIKey PHKSUFCCGLWIMC-MZHMFARDSA-N
Mol Weight 332.44 g/mol
Molecular Formula C20H28O4
Exact Mass 332.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CsJAv8C7rcS
Name 1.alpha.-(hydroxymethyl)-7.alpha.,8.alpha.-dimethyl-7-(2-(3-furyl)ethyl)bicyclo[4.4.0]dec-2-ene-2-carboxylic acid
Alternate Name(s) (5S,6R,8aS)-5-[2-(3-furyl)ethyl]-8a-(hydroxymethyl)-5,6-dimethyl-3,4,4a,5,6,7,8,8a-octahydro-1-naphthalenecarboxylic acid
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Formula C20H28O4
InChI InChI=1S/C20H28O4/c1-14-6-10-20(13-21)16(18(22)23)4-3-5-17(20)19(14,2)9-7-15-8-11-24-12-15/h4,8,11-12,14,17,21H,3,5-7,9-10,13H2,1-2H3,(H,22,23)/t14-,17?,19+,20-/m1/s1
InChIKey PHKSUFCCGLWIMC-MZHMFARDSA-N
Molecular Weight 332.440 g/mol
SMILES OC(C=1[C@]2(CO)CC[C@]([C@@](C2CCC1)(CCc1cocc1)C)(C)[H])=O
SPLASH splash10-001l-9220000000-b37f89571bb06bc2cd90
Source of Spectrum EP-2885-0-0
Wiley ID 1329579