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(E)-7-(But-2-en-1-yl)-6-chloro-7H-purine

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(E)-7-(But-2-en-1-yl)-6-chloro-7H-purine
SpectraBase Compound ID FgArFS0JMby
InChI InChI=1S/C9H9ClN4/c1-2-3-4-14-6-13-9-7(14)8(10)11-5-12-9/h2-3,5-6H,4H2,1H3/b3-2+
InChIKey KIZADTWHTFJJLX-NSCUHMNNSA-N
Mol Weight 208.65 g/mol
Molecular Formula C9H9ClN4
Exact Mass 208.051574 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IPMeG9cVXId
Name (E)-7-(But-2-en-1-yl)-6-chloro-7H-purine
Alternate Name(s) 7-[(E)-but-2-enyl]-6-chloropurine 7-[(E)-but-2-enyl]-6-chloranyl-purine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9ClN4
InChI InChI=1S/C9H9ClN4/c1-2-3-4-14-6-13-9-7(14)8(10)11-5-12-9/h2-3,5-6H,4H2,1H3/b3-2+
InChIKey KIZADTWHTFJJLX-NSCUHMNNSA-N
Molecular Weight 208.652 g/mol
SMILES c12nc[n](c2c(Cl)ncn1)C\C=C\C
SPLASH splash10-0a4i-8490000000-b6d0fb86b490ce1ddd51
Source of Spectrum U1-2013-2016-13a
Wiley ID 1735878