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1-piperidinecarboxylic acid, 4-(2-[[2-[[4-(ethoxycarbonyl)phenyl]amino]-2-oxoethyl]thio]-4-oxo-3(4H)-quinazolinyl)-, ethyl ester
SpectraBase Compound ID 9QF0Pt1J2C4
InChI InChI=1S/C27H30N4O6S/c1-3-36-25(34)18-9-11-19(12-10-18)28-23(32)17-38-26-29-22-8-6-5-7-21(22)24(33)31(26)20-13-15-30(16-14-20)27(35)37-4-2/h5-12,20H,3-4,13-17H2,1-2H3,(H,28,32)
InChIKey SYPCROOAQGBKRS-UHFFFAOYSA-N
Mol Weight 538.62 g/mol
Molecular Formula C27H30N4O6S
Exact Mass 538.188606 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID G7kZXVNAyzU
Name 1-piperidinecarboxylic acid, 4-(2-[[2-[[4-(ethoxycarbonyl)phenyl]amino]-2-oxoethyl]thio]-4-oxo-3(4H)-quinazolinyl)-, ethyl ester
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/C27H30N4O6S/c1-3-36-25(34)18-9-11-19(12-10-18)28-23(32)17-38-26-29-22-8-6-5-7-21(22)24(33)31(26)20-13-15-30(16-14-20)27(35)37-4-2/h5-12,20H,3-4,13-17H2,1-2H3,(H,28,32)
InChIKey SYPCROOAQGBKRS-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_7006
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: NMR/10328209