For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3-Bromo-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine
SpectraBase Compound ID EeJZ0No8wlD
InChI InChI=1S/C5H5BrN6/c6-2-1-3(7)9-5(8)10-4(1)12-11-2/h(H5,7,8,9,10,11,12)
InChIKey FVOVQYNWRQMJNK-UHFFFAOYSA-N
Mol Weight 229.04 g/mol
Molecular Formula C5H5BrN6
Exact Mass 227.975907 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID FaoJncsHm0t
Name 3-Bromo-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine
CAS Registry Number 144750-82-3
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H5BrN6
InChI InChI=1S/C5H5BrN6/c6-2-1-3(7)9-5(8)10-4(1)12-11-2/h(H5,7,8,9,10,11,12)
InChIKey FVOVQYNWRQMJNK-UHFFFAOYSA-N
Molecular Weight 229.041 g/mol
SMILES Nc1nc2c(c(n[nH]2)Br)c(n1)N
SPLASH splash10-0059-0090000000-30cd9c26df325f5b7ebb
Source of Spectrum F-48-8094-13
Synonyms 3-bromo-2H-pyrazolo[3,4-d]pyrimidine-4,6-diamine 3-bromanyl-2H-pyrazolo[3,4-d]pyrimidine-4,6-diamine
Wiley ID 1228962