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methyl 3-(3-{(1E)-2-cyano-3-oxo-3-[(tetrahydro-2-furanylmethyl)amino]-1-propenyl}-2,5-dimethyl-1H-pyrrol-1-yl)-2-methylbenzoate

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methyl 3-(3-{(1E)-2-cyano-3-oxo-3-[(tetrahydro-2-furanylmethyl)amino]-1-propenyl}-2,5-dimethyl-1H-pyrrol-1-yl)-2-methylbenzoate
SpectraBase Compound ID 9ZMac7hhR5p
InChI InChI=1S/C24H27N3O4/c1-15-11-18(12-19(13-25)23(28)26-14-20-7-6-10-31-20)17(3)27(15)22-9-5-8-21(16(22)2)24(29)30-4/h5,8-9,11-12,20H,6-7,10,14H2,1-4H3,(H,26,28)/b19-12+
InChIKey PABUHLRFBACFSS-XDHOZWIPSA-N
Mol Weight 421.5 g/mol
Molecular Formula C24H27N3O4
Exact Mass 421.200156 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FSHJDm2d5o8
Name methyl 3-(3-{(1E)-2-cyano-3-oxo-3-[(tetrahydro-2-furanylmethyl)amino]-1-propenyl}-2,5-dimethyl-1H-pyrrol-1-yl)-2-methylbenzoate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C24H27N3O4/c1-15-11-18(12-19(13-25)23(28)26-14-20-7-6-10-31-20)17(3)27(15)22-9-5-8-21(16(22)2)24(29)30-4/h5,8-9,11-12,20H,6-7,10,14H2,1-4H3,(H,26,28)/b19-12+
InChIKey PABUHLRFBACFSS-XDHOZWIPSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_2736
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: UZI/1008631; Labnumber: ARF3390; UZI_ID: UZI-002738
Synonyms methyl 3-(3-{2-cyano-3-oxo-3-[(tetrahydro-2-furanylmethyl)amino]-1-propenyl}-2,5-dimethyl-1H-pyrrol-1-yl)-2-methylbenzoate
Temperature 318 °C