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6-Chloranyl-9-(phenylmethyl)-2-thiophen-2-yl-purine
SpectraBase Compound ID BPmvFfPtgih
InChI InChI=1S/C16H11ClN4S/c17-14-13-16(20-15(19-14)12-7-4-8-22-12)21(10-18-13)9-11-5-2-1-3-6-11/h1-8,10H,9H2
InChIKey TZSUGHAHBIZLGC-UHFFFAOYSA-N
Mol Weight 326.81 g/mol
Molecular Formula C16H11ClN4S
Exact Mass 326.039295 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID nSKMgja3U7
Name 6-Chloranyl-9-(phenylmethyl)-2-thiophen-2-yl-purine
Alternate Name(s) 6-Chloro-9-(phenylmethyl)-2-thiophen-2-ylpurine 9-Benzyl-6-chloro-2-(2-thienyl)purine 9-Benzyl-6-chloro-2-thiophen-2-ylpurine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H11ClN4S
InChI InChI=1S/C16H11ClN4S/c17-14-13-16(20-15(19-14)12-7-4-8-22-12)21(10-18-13)9-11-5-2-1-3-6-11/h1-8,10H,9H2
InChIKey TZSUGHAHBIZLGC-UHFFFAOYSA-N
Molecular Weight 326.805 g/mol
SMILES c12c(nc[n]2Cc2ccccc2)c(Cl)nc(n1)-c1sccc1
SPLASH splash10-004l-9008000000-ee0037c6ba72ad6c2fa0
Source of Spectrum F-52-5635-9
Wiley ID 796270