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4-[N-(5-METHYLPYRID-2-YL)CARBAMOYL]-3-AMINO-2-CYANOBUTEN-2-OIC ACID,ETHYL ESTER, DIBUTYLBORYL CHELATE (ISOMER 1)
SpectraBase Compound ID IogdMPgGcFp
InChI InChI=1S/C22H33BN4O3/c1-5-8-12-23(13-9-6-2)27-16-17(4)10-11-20(27)26-21(30-23)14-19(25)18(15-24)22(28)29-7-3/h10-11,14,16,26H,5-9,12-13,25H2,1-4H3/b19-18-,21-14-
InChIKey DETWDZFOPGDRCT-DGZYFPGJSA-N
Mol Weight 414.4 g/mol
Molecular Formula C22H35BN4O3
Exact Mass 414.280221 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HDlto85Q3lC
Name 4-[N-(5-METHYLPYRID-2-YL)CARBAMOYL]-3-AMINO-2-CYANOBUTEN-2-OIC ACID,ETHYL ESTER, DIBUTYLBORYL CHELATE (ISOMER 1)
Comments S
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C22H35BN4O3
InChI InChI=1S/C22H33BN4O3/c1-5-8-12-23(13-9-6-2)27-16-17(4)10-11-20(27)26-21(30-23)14-19(25)18(15-24)22(28)29-7-3/h10-11,14,16,26H,5-9,12-13,25H2,1-4H3/b19-18-,21-14-
InChIKey DETWDZFOPGDRCT-DGZYFPGJSA-N
Instrument Name Bruker AM-300
Literature Reference V.S.BOGDANOV, S.V.BARANIN, A.DIB, I.P.YAKOVLEV, V.A.DOROKHOV (1992)Izv.Akad.Nauk SSSR(Russ. Lang.): N9, 2162-2170.
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d