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(2R)-2-[(1S,4R,4aS)-4-methyl-7-oxidanylidene-2,3,4,4a,5,6-hexahydro-1H-naphthalen-1-yl]propanoic acid
SpectraBase Compound ID JiZBa2LtDXq
InChI InChI=1S/C14H20O3/c1-8-3-5-12(9(2)14(16)17)13-7-10(15)4-6-11(8)13/h7-9,11-12H,3-6H2,1-2H3,(H,16,17)/t8-,9-,11+,12+/m1/s1
InChIKey XVDYCZISNDOFRJ-LSKIRQOJSA-N
Mol Weight 236.31 g/mol
Molecular Formula C14H20O3
Exact Mass 236.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1jDc8Nwxukg
Name (2R)-2-[(1S,4R,4aS)-4-methyl-7-oxidanylidene-2,3,4,4a,5,6-hexahydro-1H-naphthalen-1-yl]propanoic acid
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Formula C14H20O3
InChI InChI=1S/C14H20O3/c1-8-3-5-12(9(2)14(16)17)13-7-10(15)4-6-11(8)13/h7-9,11-12H,3-6H2,1-2H3,(H,16,17)/t8-,9-,11+,12+/m1/s1
InChIKey XVDYCZISNDOFRJ-LSKIRQOJSA-N
Molecular Weight 236.311 g/mol
SMILES OC([C@@]([C@]1(C=2[C@@](CCC(C2)=O)([C@@](CC1)(C)[H])[H])[H])(C)[H])=O
SPLASH splash10-03du-0940000000-bf72c113193b5b5d76eb
Source of Spectrum KC-0-3440-11
Synonyms (2R)-2-[(1S,4R,4aS)-4-methyl-7-oxo-2,3,4,4a,5,6-hexahydro-1H-naphthalen-1-yl]propanoic acid (2R)-2-[(1S,4R,4aS)-7-keto-4-methyl-2,3,4,4a,5,6-hexahydro-1H-naphthalen-1-yl]propionic acid
Wiley ID 823924