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pyrazolo[1,5-a]pyrimidine-2-carboxamide, 3-chloro-N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-5-(4-methoxyphenyl)-7-(trifluoromethyl)-
SpectraBase Compound ID Coo3ipCMbXO
InChI InChI=1S/C28H18Cl2F3N5O5/c1-14-9-19(7-8-21(14)29)43-20-11-16(10-17(12-20)38(40)41)34-27(39)25-24(30)26-35-22(15-3-5-18(42-2)6-4-15)13-23(28(31,32)33)37(26)36-25/h3-13H,1-2H3,(H,34,39)
InChIKey JXRBDERMXFRPKP-UHFFFAOYSA-N
Mol Weight 632.38 g/mol
Molecular Formula C28H18Cl2F3N5O5
Exact Mass 631.063709 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 75m1lgMPboG
Name pyrazolo[1,5-a]pyrimidine-2-carboxamide, 3-chloro-N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-5-(4-methoxyphenyl)-7-(trifluoromethyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 631.063708584 u
Formula C28H18Cl2F3N5O5
InChI InChI=1S/C28H18Cl2F3N5O5/c1-14-9-19(7-8-21(14)29)43-20-11-16(10-17(12-20)38(40)41)34-27(39)25-24(30)26-35-22(15-3-5-18(42-2)6-4-15)13-23(28(31,32)33)37(26)36-25/h3-13H,1-2H3,(H,34,39)
InChIKey JXRBDERMXFRPKP-UHFFFAOYSA-N
Molecular Weight 632.383 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_3059
Solvent DMSO-d6
Source Vendor ID: NMR/9258429; Lab Info: *1058628*; Lab Number: BAS 1058628
Temperature 23.85 °C