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1-[3-(2,6-Di-t-butyl-4-methoxyphenoxycarbonyl)-3-nitropropyl]azetidine-2-carboxylic acid, methyl ester
SpectraBase Compound ID BIdC3BapEIn
InChI InChI=1S/C24H36N2O7/c1-23(2,3)16-13-15(31-7)14-17(24(4,5)6)20(16)33-22(28)19(26(29)30)10-12-25-11-9-18(25)21(27)32-8/h13-14,18-19H,9-12H2,1-8H3
InChIKey ASUKPVRUUHZIHN-UHFFFAOYSA-N
Mol Weight 464.6 g/mol
Molecular Formula C24H36N2O7
Exact Mass 464.252252 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CnXKOjyHd1k
Name 1-[3-(2,6-Di-t-butyl-4-methoxyphenoxycarbonyl)-3-nitropropyl]azetidine-2-carboxylic acid, methyl ester
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Formula C24H36N2O7
InChI InChI=1S/C24H36N2O7/c1-23(2,3)16-13-15(31-7)14-17(24(4,5)6)20(16)33-22(28)19(26(29)30)10-12-25-11-9-18(25)21(27)32-8/h13-14,18-19H,9-12H2,1-8H3
InChIKey ASUKPVRUUHZIHN-UHFFFAOYSA-N
Molecular Weight 464.559 g/mol
SMILES CC(c1cc(cc(c1OC(=O)C(N(=O)=O)CCN1C(CC1)C(=O)OC)C(C)(C)C)OC)(C)C
SPLASH splash10-0570-6930000000-6c0531a83de364a05736
Synonyms 1-[4-(2,6-ditert-butyl-4-methoxy-phenoxy)-4-keto-3-nitro-butyl]azetidine-2-carboxylic acid methyl ester 1-[4-(2,6-ditert-butyl-4-methoxyphenoxy)-3-nitro-4-oxobutyl]-2-azetidinecarboxylic acid methyl ester Methyl 1-[4-(2,6-ditert-butyl-4-methoxy-phenoxy)-3-nitro-4-oxidanylidene-butyl]azetidine-2-carboxylate Methyl 1-[4-(2,6-ditert-butyl-4-methoxy-phenoxy)-3-nitro-4-oxo-butyl]azetidine-2-carboxylate Methyl 1-[4-(2,6-ditert-butyl-4-methoxyphenoxy)-3-nitro-4-oxobutyl]-2-azetidinecarboxylate
Wiley ID 1486696