CID 3067018

Tetrazolo(1,5-b)(1,2,4)triazine-6-carboxamide, n-methyl-7-(methylamino)-

Structural Information

Molecular Formula
C6H8N8O
SMILES
CNC1=NC2=NN=NN2N=C1C(=O)NC
InChI
InChI=1S/C6H8N8O/c1-7-4-3(5(15)8-2)11-14-6(9-4)10-12-13-14/h1-2H3,(H,8,15)(H,7,9,10,13)
InChIKey
QDMRBPBCAFIWPC-UHFFFAOYSA-N
Compound name
N-methyl-7-(methylamino)tetrazolo[1,5-b][1,2,4]triazine-6-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

208.0821 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.08938 143.8
[M+Na]+ 231.07132 155.2
[M-H]- 207.07482 142.1
[M+NH4]+ 226.11592 157.1
[M+K]+ 247.04526 152.1
[M+H-H2O]+ 191.07936 134.1
[M+HCOO]- 253.08030 164.8
[M+CH3COO]- 267.09595 155.7
[M+Na-2H]- 229.05677 153.4
[M]+ 208.08155 146.1
[M]- 208.08265 146.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.