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pyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-4-(3-ethoxy-4-hydroxyphenyl)-1,4-dihydro-3-(3-nitrophenyl)-
SpectraBase Compound ID c0ejekGYP5
InChI InChI=1S/C21H17N5O5/c1-2-30-16-9-11(6-7-15(16)27)17-14(10-22)20(23)31-21-18(17)19(24-25-21)12-4-3-5-13(8-12)26(28)29/h3-9,17,27H,2,23H2,1H3,(H,24,25)
InChIKey BXHJIPMTUGGJBP-UHFFFAOYSA-N
Mol Weight 419.4 g/mol
Molecular Formula C21H17N5O5
Exact Mass 419.122969 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Bhx952Cui5g
Name pyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-4-(3-ethoxy-4-hydroxyphenyl)-1,4-dihydro-3-(3-nitrophenyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 419.122968662 u
Formula C21H17N5O5
InChI InChI=1S/C21H17N5O5/c1-2-30-16-9-11(6-7-15(16)27)17-14(10-22)20(23)31-21-18(17)19(24-25-21)12-4-3-5-13(8-12)26(28)29/h3-9,17,27H,2,23H2,1H3,(H,24,25)
InChIKey BXHJIPMTUGGJBP-UHFFFAOYSA-N
Molecular Weight 419.397 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_5482
Solvent DMSO-d6
Source Vendor ID: NMR/9290626; Lab Info: VUR; Lab Number: VUR-0000504