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(2R)-2-[(1R,4R,4aS,8aS)-4,7-dimethyl-8-oxidanylidene-2,3,4,4a,5,8a-hexahydro-1H-naphthalen-1-yl]propanoic acid
SpectraBase Compound ID 20kkGlkehdz
InChI InChI=1S/C15H22O3/c1-8-4-7-12(10(3)15(17)18)13-11(8)6-5-9(2)14(13)16/h5,8,10-13H,4,6-7H2,1-3H3,(H,17,18)/t8-,10-,11+,12+,13+/m1/s1
InChIKey IYDIAJDXEYNLGO-WSLQDRLSSA-N
Mol Weight 250.34 g/mol
Molecular Formula C15H22O3
Exact Mass 250.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CymhnteVBLi
Name (2R)-2-[(1R,4R,4aS,8aS)-4,7-dimethyl-8-oxidanylidene-2,3,4,4a,5,8a-hexahydro-1H-naphthalen-1-yl]propanoic acid
Alternate Name(s) (2R)-2-[(1R,4R,4aS,8aS)-4,7-dimethyl-8-oxo-2,3,4,4a,5,8a-hexahydro-1H-naphthalen-1-yl]propanoic acid (2R)-2-[(1R,4R,4aS,8aS)-8-keto-4,7-dimethyl-2,3,4,4a,5,8a-hexahydro-1H-naphthalen-1-yl]propionic acid
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Formula C15H22O3
InChI InChI=1S/C15H22O3/c1-8-4-7-12(10(3)15(17)18)13-11(8)6-5-9(2)14(13)16/h5,8,10-13H,4,6-7H2,1-3H3,(H,17,18)/t8-,10-,11+,12+,13+/m1/s1
InChIKey IYDIAJDXEYNLGO-WSLQDRLSSA-N
Molecular Weight 250.338 g/mol
SMILES OC([C@@]([C@]1([C@]2(C(C(C)=CC[C@]2([C@@](CC1)(C)[H])[H])=O)[H])[H])(C)[H])=O
SPLASH splash10-0udi-0790000000-703018866ec2bc59742b
Source of Spectrum F-54-4354-9
Wiley ID 806579