CID 105266

66104-34-5

Structural Information

Molecular Formula
C12H11N5O
SMILES
COC1=CC=C(C=C1)N2N=C3C=CC(=NC3=N2)N
InChI
InChI=1S/C12H11N5O/c1-18-9-4-2-8(3-5-9)17-15-10-6-7-11(13)14-12(10)16-17/h2-7H,1H3,(H2,13,14,16)
InChIKey
AVWBWRNIAZRTHF-UHFFFAOYSA-N
Compound name
2-(4-methoxyphenyl)triazolo[4,5-b]pyridin-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

241.09636 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.10364 151.8
[M+Na]+ 264.08558 167.2
[M+NH4]+ 259.13018 159.2
[M+K]+ 280.05952 162.4
[M-H]- 240.08908 154.7
[M+Na-2H]- 262.07103 160.6
[M]+ 241.09581 154.8
[M]- 241.09691 154.8
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.