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pyrido[2,3-d]pyrimidin-4(1H)-one, 7-(1,3-benzodioxol-5-yl)-1-cyclopropyl-5-(difluoromethyl)-2-mercapto-
SpectraBase Compound ID CjLMWBsKrkr
InChI InChI=1S/C18H13F2N3O3S/c19-15(20)10-6-11(8-1-4-12-13(5-8)26-7-25-12)21-16-14(10)17(24)22-18(27)23(16)9-2-3-9/h1,4-6,9,15H,2-3,7H2,(H,22,24,27)
InChIKey ZLVYZIVVWNVAJN-UHFFFAOYSA-N
Mol Weight 389.38 g/mol
Molecular Formula C18H13F2N3O3S
Exact Mass 389.064569 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1FaalGFgmoe
Name pyrido[2,3-d]pyrimidin-4(1H)-one, 7-(1,3-benzodioxol-5-yl)-1-cyclopropyl-5-(difluoromethyl)-2-mercapto-
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/C18H13F2N3O3S/c19-15(20)10-6-11(8-1-4-12-13(5-8)26-7-25-12)21-16-14(10)17(24)22-18(27)23(16)9-2-3-9/h1,4-6,9,15H,2-3,7H2,(H,22,24,27)
InChIKey ZLVYZIVVWNVAJN-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_23445
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: 2279029; UZI_ID: UZI-023453
Temperature 308 °C