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1-piperidinecarboxylic acid, 4-(4-oxo-2-[[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]thio]-3(4H)-quinazolinyl)-, ethyl ester

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1-piperidinecarboxylic acid, 4-(4-oxo-2-[[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]thio]-3(4H)-quinazolinyl)-, ethyl ester
SpectraBase Compound ID 8i5QE0iF3jT
InChI InChI=1S/C25H25N5O4S/c1-2-34-25(33)28-13-10-18(11-14-28)30-23(32)19-7-3-4-8-20(19)27-24(30)35-16-17-15-22(31)29-12-6-5-9-21(29)26-17/h3-9,12,15,18H,2,10-11,13-14,16H2,1H3
InChIKey QBDJPWYHFZCLBK-UHFFFAOYSA-N
Mol Weight 491.57 g/mol
Molecular Formula C25H25N5O4S
Exact Mass 491.162725 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KqCfkSibM7F
Name 1-piperidinecarboxylic acid, 4-(4-oxo-2-[[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]thio]-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/C25H25N5O4S/c1-2-34-25(33)28-13-10-18(11-14-28)30-23(32)19-7-3-4-8-20(19)27-24(30)35-16-17-15-22(31)29-12-6-5-9-21(29)26-17/h3-9,12,15,18H,2,10-11,13-14,16H2,1H3
InChIKey QBDJPWYHFZCLBK-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_7011
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/10328214