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isonicotinaldehyde {7-[(2E)-3-chloro-2-butenyl]-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}hydrazone
SpectraBase Compound ID ETEdj8MbwWh
InChI InChI=1S/C17H18ClN7O2/c1-11(18)6-9-25-13-14(23(2)17(27)24(3)15(13)26)21-16(25)22-20-10-12-4-7-19-8-5-12/h4-8,10H,9H2,1-3H3,(H,21,22)/b11-6+,20-10+
InChIKey WPPZKQXXBGRPCN-XMONHYIXSA-N
Mol Weight 387.83 g/mol
Molecular Formula C17H18ClN7O2
Exact Mass 387.121051 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID E0XXtOAC6FU
Name isonicotinaldehyde {7-[(2E)-3-chloro-2-butenyl]-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}hydrazone
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/C17H18ClN7O2/c1-11(18)6-9-25-13-14(23(2)17(27)24(3)15(13)26)21-16(25)22-20-10-12-4-7-19-8-5-12/h4-8,10H,9H2,1-3H3,(H,21,22)/b11-6+,20-10+
InChIKey WPPZKQXXBGRPCN-XMONHYIXSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_25201
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: D49528; Labnumber: UZROM-3891; SBI_ID: SBI-025205
Synonyms isonicotinaldehyde {7-[3-chloro-2-butenyl]-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}hydrazone
Temperature 300 °C