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Ethyl (3R,4S,5R)-3-(1-Ethylpropoxy)-5-N-formylamino-4-methanesulfonyloxy-1-cyclohexene-1-carboxylate
SpectraBase Compound ID 2CcnFOQ9caH
InChI InChI=1S/C16H27NO7S/c1-5-12(6-2)23-14-9-11(16(19)22-7-3)8-13(17-10-18)15(14)24-25(4,20)21/h9-10,12-15H,5-8H2,1-4H3,(H,17,18)/t13-,14-,15+/m1/s1
InChIKey BUCLHCNFBVUDFE-KFWWJZLASA-N
Mol Weight 377.45 g/mol
Molecular Formula C16H27NO7S
Exact Mass 377.150823 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DpJG5Ds3qJv
Name Ethyl (3R,4S,5R)-3-(1-Ethylpropoxy)-5-N-formylamino-4-methanesulfonyloxy-1-cyclohexene-1-carboxylate
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Formula C16H27NO7S
InChI InChI=1S/C16H27NO7S/c1-5-12(6-2)23-14-9-11(16(19)22-7-3)8-13(17-10-18)15(14)24-25(4,20)21/h9-10,12-15H,5-8H2,1-4H3,(H,17,18)/t13-,14-,15+/m1/s1
InChIKey BUCLHCNFBVUDFE-KFWWJZLASA-N
Molecular Weight 377.452 g/mol
SMILES N(C=O)[C@]1([C@](OS(=O)(=O)C)([C@@](C=C(C1)C(=O)OCC)(OC(CC)CC)[H])[H])[H]
SPLASH splash10-0007-1930000000-7e83db893db123fd5efc
Source of Spectrum J-66-2051-34
Synonyms Ethyl (3R,4S,5R)-3-(1-ethylpropoxy)-5-(formylamino)-4-[(methylsulfonyl)oxy]-1-cyclohexene-1-carboxylate (3R,4S,5R)-5-formamido-4-methylsulfonyloxy-3-pentan-3-yloxy-1-cyclohexenecarboxylic acid ethyl ester Ethyl (3R,4S,5R)-5-formamido-4-methylsulfonyloxy-3-pentan-3-yloxycyclohexene-1-carboxylate Ethyl (3R,4S,5R)-3-(1-ethylpropoxy)-5-formamido-4-methylsulfonyloxy-cyclohexene-1-carboxylate Ethyl (3R,4S,5R)-5-formamido-4-methylsulfonyloxy-3-pentan-3-yloxy-cyclohexene-1-carboxylate
Wiley ID 1534839