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pyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-4-(1,3-benzodioxol-5-yl)-1,4-dihydro-3-(4-nitrophenyl)-
SpectraBase Compound ID I3KeHf25OAO
InChI InChI=1S/C20H13N5O5/c21-8-13-16(11-3-6-14-15(7-11)29-9-28-14)17-18(23-24-20(17)30-19(13)22)10-1-4-12(5-2-10)25(26)27/h1-7,16H,9,22H2,(H,23,24)
InChIKey CKJGMRLCLXPHSD-UHFFFAOYSA-N
Mol Weight 403.35 g/mol
Molecular Formula C20H13N5O5
Exact Mass 403.091669 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ASoEamPySh
Name pyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-4-(1,3-benzodioxol-5-yl)-1,4-dihydro-3-(4-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 403.091668534 u
Formula C20H13N5O5
InChI InChI=1S/C20H13N5O5/c21-8-13-16(11-3-6-14-15(7-11)29-9-28-14)17-18(23-24-20(17)30-19(13)22)10-1-4-12(5-2-10)25(26)27/h1-7,16H,9,22H2,(H,23,24)
InChIKey CKJGMRLCLXPHSD-UHFFFAOYSA-N
Molecular Weight 403.354 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_5480
Solvent DMSO-d6
Source Vendor ID: NMR/9264875; Lab Info: VUR; Lab Number: VUR-0000468