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2-Amino-2-[(3S)-3-(2-methoxy-2-oxoethyl)-4,4-dimethyl-5-oxocyclohexyl]acetic acid ethyl ester
SpectraBase Compound ID KqmZoHOVpIq
InChI InChI=1S/C15H25NO5/c1-5-21-14(19)13(16)9-6-10(8-12(18)20-4)15(2,3)11(17)7-9/h9-10,13H,5-8,16H2,1-4H3/t9?,10-,13?/m0/s1
InChIKey LGZUYIUZEFVGJL-QUNCOHTASA-N
Mol Weight 299.37 g/mol
Molecular Formula C15H25NO5
Exact Mass 299.173273 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DEZexWQIYHh
Name 2-Amino-2-[(3S)-3-(2-methoxy-2-oxoethyl)-4,4-dimethyl-5-oxocyclohexyl]acetic acid ethyl ester
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Formula C15H25NO5
InChI InChI=1S/C15H25NO5/c1-5-21-14(19)13(16)9-6-10(8-12(18)20-4)15(2,3)11(17)7-9/h9-10,13H,5-8,16H2,1-4H3/t9?,10-,13?/m0/s1
InChIKey LGZUYIUZEFVGJL-QUNCOHTASA-N
Molecular Weight 299.367 g/mol
SMILES NC(C(=O)OCC)C1C[C@](C(C(C1)=O)(C)C)(CC(=O)OC)[H]
SPLASH splash10-004i-1690000000-8bf8ac63ae9037a35b69
Source of Spectrum H-80-1860-0
Synonyms 2-Amino-2-[(5S)-3-keto-5-(2-keto-2-methoxy-ethyl)-4,4-dimethyl-cyclohexyl]acetic acid ethyl ester Ethyl 2-amino-2-[(3S)-3-(2-methoxy-2-oxo-ethyl)-4,4-dimethyl-5-oxo-cyclohexyl]acetate Ethyl 2-azanyl-2-[(3S)-3-(2-methoxy-2-oxidanylidene-ethyl)-4,4-dimethyl-5-oxidanylidene-cyclohexyl]ethanoate
Wiley ID 1301885