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methyl (3R)-6'-amino-5'-cyano-2'-(2-methoxy-2-oxoethyl)-2-oxo-1-prop-2-ynylspiro[indole-3,4'-pyran]-3'-carboxylate methyl (3R)-6'-amino-5'-cyano-2'-(2-methoxy-2-oxo-ethyl)-2-oxo-1-prop-2-ynyl-spiro[indoline-3,4'-pyran]-3'-carboxylate (3R)-6'-amino-5'-cyano-2'-(2-methoxy-2-oxoethyl)-2-oxo-1-prop-2-ynyl-3'-spiro[indoline-3,4'-pyran]carboxylic acid methyl ester (3R)-6'-amino-5'-cyano-2-keto-2'-(2-keto-2-methoxy-ethyl)-1-propargyl-spiro[indoline-3,4'-pyran]-3'-carboxylic acid methyl ester methyl (3R)-6'-amino-5'-cyano-2'-(2-methoxy-2-oxo-ethyl)-2-oxo-1-prop-2-ynyl-spiro[indole-3,4'-pyran]-3'-carboxylate
SpectraBase Compound ID HCW3RlOoNfA
InChI InChI=1S/C21H17N3O6/c1-4-9-24-14-8-6-5-7-12(14)21(20(24)27)13(11-22)18(23)30-15(10-16(25)28-2)17(21)19(26)29-3/h1,5-8H,9-10,23H2,2-3H3/t21-/m1/s1
InChIKey HUDSQBRAXKSXIM-OAQYLSRUSA-N
Mol Weight 407.38 g/mol
Molecular Formula C21H17N3O6
Exact Mass 407.111735 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IomipnvRSvn
Name methyl (3R)-6'-amino-5'-cyano-2'-(2-methoxy-2-oxoethyl)-2-oxo-1-prop-2-ynylspiro[indole-3,4'-pyran]-3'-carboxylate methyl (3R)-6'-amino-5'-cyano-2'-(2-methoxy-2-oxo-ethyl)-2-oxo-1-prop-2-ynyl-spiro[indoline-3,4'-pyran]-3'-carboxylate (3R)-6'-amino-5'-cyano-2'-(2-methoxy-2-oxoethyl)-2-oxo-1-prop-2-ynyl-3'-spiro[indoline-3,4'-pyran]carboxylic acid methyl ester (3R)-6'-amino-5'-cyano-2-keto-2'-(2-keto-2-methoxy-ethyl)-1-propargyl-spiro[indoline-3,4'-pyran]-3'-carboxylic acid methyl ester methyl (3R)-6'-amino-5'-cyano-2'-(2-methoxy-2-oxo-ethyl)-2-oxo-1-prop-2-ynyl-spiro[indole-3,4'-pyran]-3'-carboxylate
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Exact Mass 407.111735273 u
Formula C21H17N3O6
InChI InChI=1S/C21H17N3O6/c1-4-9-24-14-8-6-5-7-12(14)21(20(24)27)13(11-22)18(23)30-15(10-16(25)28-2)17(21)19(26)29-3/h1,5-8H,9-10,23H2,2-3H3/t21-/m1/s1
InChIKey HUDSQBRAXKSXIM-OAQYLSRUSA-N
Molecular Weight 407.382 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_2358
Solvent DMSO-d6
Source Vendor ID: NMR/12279331