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(3R,4R,5S)-4-amino-3-(1-ethylpropoxy)-5-hydroxy-cyclohexene-1-carboxylic acid ethyl ester
SpectraBase Compound ID L3gBhmfYzga
InChI InChI=1S/C14H25NO4/c1-4-10(5-2)19-12-8-9(14(17)18-6-3)7-11(16)13(12)15/h8,10-13,16H,4-7,15H2,1-3H3/t11-,12+,13+/m0/s1
InChIKey OZDBGFQMBOJOLY-YNEHKIRRSA-N
Mol Weight 271.36 g/mol
Molecular Formula C14H25NO4
Exact Mass 271.178358 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ourdF8bWRa
Name (3R,4R,5S)-4-amino-3-(1-ethylpropoxy)-5-hydroxy-cyclohexene-1-carboxylic acid ethyl ester
Alternate Name(s) (3R,4R,5S)-4-amino-5-hydroxy-3-pentan-3-yloxy-1-cyclohexenecarboxylic acid ethyl ester Ethyl (3R,4R,5S)-4-amino-3-(1-ethylpropoxy)-5-hydroxy-cyclohexene-1-carboxylate Ethyl (3R,4R,5S)-4-amino-5-hydroxy-3-pentan-3-yloxycyclohexene-1-carboxylate Ethyl (3R,4R,5S)-4-azanyl-5-oxidanyl-3-pentan-3-yloxy-cyclohexene-1-carboxylate
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Formula C14H25NO4
InChI InChI=1S/C14H25NO4/c1-4-10(5-2)19-12-8-9(14(17)18-6-3)7-11(16)13(12)15/h8,10-13,16H,4-7,15H2,1-3H3/t11-,12+,13+/m0/s1
InChIKey OZDBGFQMBOJOLY-YNEHKIRRSA-N
Molecular Weight 271.357 g/mol
SMILES O[C@]1(CC(=C[C@]([C@@]1(N)[H])(OC(CC)CC)[H])C(=O)OCC)[H]
SPLASH splash10-0007-4920000000-aca9e9735977a535dcca
Source of Spectrum J-66-2049-20
Wiley ID 1534844