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phenylmethyl (3R)-6'-amino-5'-cyano-2'-methyl-2-oxo-1-prop-2-enylspiro[indole-3,4'-pyran]-3'-carboxylate phenylmethyl (3R)-1-allyl-6'-amino-5'-cyano-2'-methyl-2-oxo-spiro[indoline-3,4'-pyran]-3'-carboxylate (3R)-1-allyl-6'-amino-5'-cyano-2'-methyl-2-oxo-3'-spiro[indoline-3,4'-pyran]carboxylic acid phenylmethyl ester (3R)-1-allyl-6'-amino-5'-cyano-2-keto-2'-methyl-spiro[indoline-3,4'-pyran]-3'-carboxylic acid benzyl ester phenylmethyl (3R)-6'-amino-5'-cyano-2'-methyl-2-oxo-1-prop-2-enyl-spiro[indole-3,4'-pyran]-3'-carboxylate
SpectraBase Compound ID Dfi5VMVvk9f
InChI InChI=1S/C25H21N3O4/c1-3-13-28-20-12-8-7-11-18(20)25(24(28)30)19(14-26)22(27)32-16(2)21(25)23(29)31-15-17-9-5-4-6-10-17/h3-12H,1,13,15,27H2,2H3/t25-/m1/s1
InChIKey MQYPUUDNNFCSCA-RUZDIDTESA-N
Mol Weight 427.46 g/mol
Molecular Formula C25H21N3O4
Exact Mass 427.153206 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9zalESNPxWy
Name phenylmethyl (3R)-6'-amino-5'-cyano-2'-methyl-2-oxo-1-prop-2-enylspiro[indole-3,4'-pyran]-3'-carboxylate phenylmethyl (3R)-1-allyl-6'-amino-5'-cyano-2'-methyl-2-oxo-spiro[indoline-3,4'-pyran]-3'-carboxylate (3R)-1-allyl-6'-amino-5'-cyano-2'-methyl-2-oxo-3'-spiro[indoline-3,4'-pyran]carboxylic acid phenylmethyl ester (3R)-1-allyl-6'-amino-5'-cyano-2-keto-2'-methyl-spiro[indoline-3,4'-pyran]-3'-carboxylic acid benzyl ester phenylmethyl (3R)-6'-amino-5'-cyano-2'-methyl-2-oxo-1-prop-2-enyl-spiro[indole-3,4'-pyran]-3'-carboxylate
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 427.153206164 u
Formula C25H21N3O4
InChI InChI=1S/C25H21N3O4/c1-3-13-28-20-12-8-7-11-18(20)25(24(28)30)19(14-26)22(27)32-16(2)21(25)23(29)31-15-17-9-5-4-6-10-17/h3-12H,1,13,15,27H2,2H3/t25-/m1/s1
InChIKey MQYPUUDNNFCSCA-RUZDIDTESA-N
Molecular Weight 427.460 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_2328
Solvent DMSO-d6
Source Vendor ID: NMR/12279292