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pyrido[2,3-d]pyrimidin-4(1H)-one, 2-mercapto-1-(2-propenyl)-7-tricyclo[3.3.1.1~3,7~]dec-1-yl-5-(trifluoromethyl)-
SpectraBase Compound ID 4buVab2EkNR
InChI InChI=1S/C21H22F3N3OS/c1-2-3-27-17-16(18(28)26-19(27)29)14(21(22,23)24)7-15(25-17)20-8-11-4-12(9-20)6-13(5-11)10-20/h2,7,11-13H,1,3-6,8-10H2,(H,26,28,29)
InChIKey DQFLZWLJSTTZAZ-UHFFFAOYSA-N
Mol Weight 421.48 g/mol
Molecular Formula C21H22F3N3OS
Exact Mass 421.143568 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5Wo1QXUdtKn
Name pyrido[2,3-d]pyrimidin-4(1H)-one, 2-mercapto-1-(2-propenyl)-7-tricyclo[3.3.1.1~3,7~]dec-1-yl-5-(trifluoromethyl)-
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/C21H22F3N3OS/c1-2-3-27-17-16(18(28)26-19(27)29)14(21(22,23)24)7-15(25-17)20-8-11-4-12(9-20)6-13(5-11)10-20/h2,7,11-13H,1,3-6,8-10H2,(H,26,28,29)
InChIKey DQFLZWLJSTTZAZ-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_23679
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: 2283705; UZI_ID: UZI-023687
Temperature 308 °C