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

*Links on SpectraBase are not permalinks.
3-Amino-6-(trifluoromethyl)-9H-[1,2,4]triazolo[4,3-b][1,2,4]triazepin-8-ol
SpectraBase Compound ID H2LxLVUXuFZ
InChI InChI=1S/C6H5F3N6O/c7-6(8,9)2-1-3(16)11-5-13-12-4(10)15(5)14-2/h1,16H,(H2,10,12)(H,11,13)
InChIKey VRTPYNKMQNPQRP-UHFFFAOYSA-N
Mol Weight 234.14 g/mol
Molecular Formula C6H5F3N6O
Exact Mass 234.047693 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 3zHV7wvJAhg
Name 3-Amino-6-(trifluoromethyl)-9H-[1,2,4]triazolo[4,3-b][1,2,4]triazepin-8-ol
Alternate Name(s) 9H-1,2,4-Triazolo[4,3-b][1,2,4]-triazepin-8-ol, 3-amino-6-trifluoromethyl- 3-Azanyl-6-(trifluoromethyl)-9H-[1,2,4]triazolo[4,3-b][1,2,4]triazepin-9-ium-8-olate
CAS Registry Number 294875-48-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H5F3N6O
InChI InChI=1S/C6H5F3N6O/c7-6(8,9)2-1-3(16)11-5-13-12-4(10)15(5)14-2/h1,16H,(H2,10,12)(H,11,13)
InChIKey VRTPYNKMQNPQRP-UHFFFAOYSA-N
Molecular Weight 234.142 g/mol
SMILES N1c2[n](N=C(C=C1O)C(F)(F)F)c(nn2)N
SPLASH splash10-00kf-9200000000-151fc2b8583b345c38cb
Source of Spectrum AD-0-2532-0
Wiley ID 1426036