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

*Links on SpectraBase are not permalinks.
N-(5-amino-1H-1,2,4-triazol-3-yl)-2,2,3,3,4,4,4-heptafluoro-butanamide
SpectraBase Compound ID COdC6XoOttQ
InChI InChI=1S/C6H4F7N5O/c7-4(8,5(9,10)6(11,12)13)1(19)15-3-16-2(14)17-18-3/h(H4,14,15,16,17,18,19)
InChIKey IHNMGAZHPNQKRF-UHFFFAOYSA-N
Mol Weight 295.12 g/mol
Molecular Formula C6H4F7N5O
Exact Mass 295.030407 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 JtVZ0DiErW8
Name N-(5-amino-1H-1,2,4-triazol-3-yl)-2,2,3,3,4,4,4-heptafluoro-butanamide
CAS Registry Number 80616-59-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H4F7N5O
InChI InChI=1S/C6H4F7N5O/c7-4(8,5(9,10)6(11,12)13)1(19)15-3-16-2(14)17-18-3/h(H4,14,15,16,17,18,19)
InChIKey IHNMGAZHPNQKRF-UHFFFAOYSA-N
Molecular Weight 295.121 g/mol
SMILES N(c1nc(n[nH]1)N)C(C(C(C(F)(F)F)(F)F)(F)F)=O
SPLASH splash10-006t-9560000000-c472d7716cf1c9d66dff
Source of Spectrum 0-16-374-1
Synonyms N-(5-amino-1H-1,2,4-triazol-3-yl)-2,2,3,3,4,4,4-heptafluoro-butyramide N-(5-azanyl-1H-1,2,4-triazol-3-yl)-2,2,3,3,4,4,4-heptakis(fluoranyl)butanamide
Wiley ID 1297911