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(2S)-2-[(2R,4aS)-4a,8-dimethyl-7-oxo-1,2,3,4-tetrahydronaphthalen-2-yl]propanoic acid methyl ester
SpectraBase Compound ID C15zF672ApN
InChI InChI=1S/C16H22O3/c1-10(15(18)19-4)12-5-7-16(3)8-6-14(17)11(2)13(16)9-12/h6,8,10,12H,5,7,9H2,1-4H3/t10-,12+,16-/m0/s1
InChIKey KHGUCHIBOSMCAE-IETSOEAISA-N
Mol Weight 262.35 g/mol
Molecular Formula C16H22O3
Exact Mass 262.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IjJqcxSydJ8
Name (2S)-2-[(2R,4aS)-4a,8-dimethyl-7-oxo-1,2,3,4-tetrahydronaphthalen-2-yl]propanoic acid methyl ester
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Formula C16H22O3
InChI InChI=1S/C16H22O3/c1-10(15(18)19-4)12-5-7-16(3)8-6-14(17)11(2)13(16)9-12/h6,8,10,12H,5,7,9H2,1-4H3/t10-,12+,16-/m0/s1
InChIKey KHGUCHIBOSMCAE-IETSOEAISA-N
Molecular Weight 262.349 g/mol
SMILES C12=C(C(=O)C=C[C@@]2(CC[C@](C1)([C@@](C(=O)OC)(C)[H])[H])C)C
SPLASH splash10-004i-0970000000-7b5ddd786cfc2144f7ce
Source of Spectrum F-68-4426-0
Synonyms (2S)-2-[(2R,4aS)-7-keto-4a,8-dimethyl-1,2,3,4-tetrahydronaphthalen-2-yl]propionic acid methyl ester Methyl (2S)-2-[(2R,4aS)-4a,8-dimethyl-7-oxidanylidene-1,2,3,4-tetrahydronaphthalen-2-yl]propanoate Methyl (2S)-2-[(2R,4aS)-4a,8-dimethyl-7-oxo-1,2,3,4-tetrahydronaphthalen-2-yl]propanoate
Wiley ID 1572612