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9-Benzyl-8-bromoadenine
SpectraBase Compound ID IljtewtZ2AN
InChI InChI=1S/C12H10BrN5/c13-12-17-9-10(14)15-7-16-11(9)18(12)6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H2,14,15,16)
InChIKey OUPAEJUFVKPEHM-UHFFFAOYSA-N
Mol Weight 304.15 g/mol
Molecular Formula C12H10BrN5
Exact Mass 303.011958 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dq2euIEqPja
Name 9-Benzyl-8-bromoadenine
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10BrN5
InChI InChI=1S/C12H10BrN5/c13-12-17-9-10(14)15-7-16-11(9)18(12)6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H2,14,15,16)
InChIKey OUPAEJUFVKPEHM-UHFFFAOYSA-N
Molecular Weight 304.151 g/mol
SMILES Nc1c2c([n](c(n2)Br)Cc2ccccc2)ncn1
SPLASH splash10-0006-9003000000-97ffd6e0e7a0e9ce3327
Source of Spectrum SO-0-1707-3
Synonyms (9-benzyl-8-bromo-purin-6-yl)amine 8-bromanyl-9-(phenylmethyl)purin-6-amine 8-bromo-9-(phenylmethyl)-6-purinamine 9-benzyl-8-bromo-9H-purin-6-amine 9-benzyl-8-bromo-purin-6-amine
Wiley ID 878584