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2-hydroxybenzaldehyde {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 7Lx898MMhOF
InChI InChI=1S/C18H19ClN6O3/c1-11(19)8-9-25-14-15(23(2)18(28)24(3)16(14)27)21-17(25)22-20-10-12-6-4-5-7-13(12)26/h4-8,10,26H,9H2,1-3H3,(H,21,22)/b11-8+,20-10+
InChIKey XPWCVNPKXNPAAT-XNXZNTANSA-N
Mol Weight 402.84 g/mol
Molecular Formula C18H19ClN6O3
Exact Mass 402.120716 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID qVkIjsXNst
Name 2-hydroxybenzaldehyde {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/C18H19ClN6O3/c1-11(19)8-9-25-14-15(23(2)18(28)24(3)16(14)27)21-17(25)22-20-10-12-6-4-5-7-13(12)26/h4-8,10,26H,9H2,1-3H3,(H,21,22)/b11-8+,20-10+
InChIKey XPWCVNPKXNPAAT-XNXZNTANSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_25198
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: D49521; Labnumber: UZROM-3877; SBI_ID: SBI-025202
Synonyms 2-hydroxybenzaldehyde {7-[3-chloro-2-butenyl]-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}hydrazone
Temperature 300 °C