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7-[(2E)-3-chloro-2-butenyl]-1,3-dimethyl-8-[(2E)-2-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazino]-3,7-dihydro-1H-purine-2,6-dione

View entire compound with spectra: 1 NMR

7-[(2E)-3-chloro-2-butenyl]-1,3-dimethyl-8-[(2E)-2-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazino]-3,7-dihydro-1H-purine-2,6-dione
SpectraBase Compound ID 90KmjF0OqJE
InChI InChI=1S/C19H18ClN7O3/c1-10(20)8-9-27-14-15(25(2)19(30)26(3)17(14)29)22-18(27)24-23-13-11-6-4-5-7-12(11)21-16(13)28/h4-8H,9H2,1-3H3,(H,22,24)(H,21,23,28)/b10-8+
InChIKey URHLRTGWALYJOL-CSKARUKUSA-N
Mol Weight 427.85 g/mol
Molecular Formula C19H18ClN7O3
Exact Mass 427.115965 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3Qkl1GB8pCt
Name 7-[(2E)-3-chloro-2-butenyl]-1,3-dimethyl-8-[(2E)-2-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazino]-3,7-dihydro-1H-purine-2,6-dione
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/C19H18ClN7O3/c1-10(20)8-9-27-14-15(25(2)19(30)26(3)17(14)29)22-18(27)24-23-13-11-6-4-5-7-12(11)21-16(13)28/h4-8H,9H2,1-3H3,(H,22,24)(H,21,23,28)/b10-8+
InChIKey URHLRTGWALYJOL-CSKARUKUSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_25200
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: D49526; Labnumber: UZROM-3888; SBI_ID: SBI-025204
Synonyms 7-[3-chloro-2-butenyl]-1,3-dimethyl-8-[2-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazino]-3,7-dihydro-1H-purine-2,6-dione
Temperature 300 °C