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methyl 4-[2-chloro-7-(2-methylphenyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidin-6-yl]benzoate
SpectraBase Compound ID DU2i6nMIDif
InChI InChI=1S/C27H21ClN4O3/c1-15-5-3-4-6-19(15)24-22-23(31-27-29-14-30-32(24)27)20-13-18(28)11-12-21(20)35-25(22)16-7-9-17(10-8-16)26(33)34-2/h3-14,24-25H,1-2H3,(H,29,30,31)
InChIKey ZNGHGEYZPPTOMR-UHFFFAOYSA-N
Mol Weight 484.94 g/mol
Molecular Formula C27H21ClN4O3
Exact Mass 484.130218 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CcdmvTXNfwO
Name methyl 4-[2-chloro-7-(2-methylphenyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidin-6-yl]benzoate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C27H21ClN4O3/c1-15-5-3-4-6-19(15)24-22-23(31-27-29-14-30-32(24)27)20-13-18(28)11-12-21(20)35-25(22)16-7-9-17(10-8-16)26(33)34-2/h3-14,24-25H,1-2H3,(H,29,30,31)
InChIKey ZNGHGEYZPPTOMR-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_26889
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: D66757; Labnumber: ExRud-01450; SBI_ID: SBI-026893
Temperature 306 °C