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Ethyl (3R,4S,5R)-3-(1-Ethylpropoxy)-4-hydroxy-5-N-propylamino-1-cyclohexene-1-carboxylate
SpectraBase Compound ID 3nQYVhdhKiE
InChI InChI=1S/C17H31NO4/c1-5-9-18-14-10-12(17(20)21-8-4)11-15(16(14)19)22-13(6-2)7-3/h11,13-16,18-19H,5-10H2,1-4H3/t14-,15-,16+/m1/s1
InChIKey SYUOUTPPCSTAHN-OAGGEKHMSA-N
Mol Weight 313.44 g/mol
Molecular Formula C17H31NO4
Exact Mass 313.225308 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DBnxQgHvWB
Name Ethyl (3R,4S,5R)-3-(1-Ethylpropoxy)-4-hydroxy-5-N-propylamino-1-cyclohexene-1-carboxylate
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Formula C17H31NO4
InChI InChI=1S/C17H31NO4/c1-5-9-18-14-10-12(17(20)21-8-4)11-15(16(14)19)22-13(6-2)7-3/h11,13-16,18-19H,5-10H2,1-4H3/t14-,15-,16+/m1/s1
InChIKey SYUOUTPPCSTAHN-OAGGEKHMSA-N
Molecular Weight 313.438 g/mol
SMILES N([C@]1([C@@]([C@@](C=C(C1)C(=O)OCC)(OC(CC)CC)[H])(O)[H])[H])CCC
SPLASH splash10-0w2c-0690000000-f0f3f5d29374643cbc60
Source of Spectrum J-66-2050-25
Synonyms Ethyl (3R,4S,5R)-3-(1-ethylpropoxy)-4-hydroxy-5-(propylamino)-1-cyclohexene-1-carboxylate (3R,4S,5R)-4-hydroxy-3-pentan-3-yloxy-5-(propylamino)-1-cyclohexenecarboxylic acid ethyl ester Ethyl (3R,4S,5R)-4-hydroxy-3-pentan-3-yloxy-5-(propylamino)cyclohexene-1-carboxylate Ethyl (3R,4S,5R)-3-(1-ethylpropoxy)-4-hydroxy-5-(propylamino)cyclohexene-1-carboxylate Ethyl (3R,4S,5R)-4-oxidanyl-3-pentan-3-yloxy-5-(propylamino)cyclohexene-1-carboxylate
Wiley ID 1534842