7-[(2E)-3-chloro-2-butenyl]-8-[(2-furylmethyl)amino]-3-methyl-3,7-dihydro-1H-purine-2,6-dione

SpectraBase Compound ID	iPhKsNqOk9
InChI	InChI=1S/C15H16ClN5O3/c1-9(16)5-6-21-11-12(20(2)15(23)19-13(11)22)18-14(21)17-8-10-4-3-7-24-10/h3-5,7H,6,8H2,1-2H3,(H,17,18)(H,19,22,23)/b9-5+
InChIKey	CTDOVSIQFJCNMK-WEVVVXLNSA-N Google Search
Mol Weight	349.78 g/mol
Molecular Formula	C15H16ClN5O3
Exact Mass	349.094167 g/mol

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SpectraBase Spectrum ID	5VD18SzO4BC
Name	7-[(2E)-3-chloro-2-butenyl]-8-[(2-furylmethyl)amino]-3-methyl-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/C15H16ClN5O3/c1-9(16)5-6-21-11-12(20(2)15(23)19-13(11)22)18-14(21)17-8-10-4-3-7-24-10/h3-5,7H,6,8H2,1-2H3,(H,17,18)(H,19,22,23)/b9-5+
InChIKey	CTDOVSIQFJCNMK-WEVVVXLNSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_25054
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: D49471; Labnumber: UZROM-3797; SBI_ID: SBI-025058
Synonyms	7-[3-chloro-2-butenyl]-8-[(2-furylmethyl)amino]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Temperature	308 °C