CID 79200283

2361851-12-7

Structural Information

Molecular Formula
C9H12N4O
SMILES
C1=CC2=NN=C(N2C=C1N)CCCO
InChI
InChI=1S/C9H12N4O/c10-7-3-4-9-12-11-8(2-1-5-14)13(9)6-7/h3-4,6,14H,1-2,5,10H2
InChIKey
AKJAMEXLWVXKBG-UHFFFAOYSA-N
Compound name
3-(6-amino-[1,2,4]triazolo[4,3-a]pyridin-3-yl)propan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

192.1011 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.10838 139.9
[M+Na]+ 215.09032 150.3
[M-H]- 191.09382 139.5
[M+NH4]+ 210.13492 157.6
[M+K]+ 231.06426 146.3
[M+H-H2O]+ 175.09836 132.1
[M+HCOO]- 237.09930 161.8
[M+CH3COO]- 251.11495 152.6
[M+Na-2H]- 213.07577 147.2
[M]+ 192.10055 141.0
[M]- 192.10165 141.0
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.