CID 4885555

832737-20-9

Structural Information

Molecular Formula
C10H14N4O
SMILES
CC1=CC(=NC2=NC(=NN12)CCCO)C
InChI
InChI=1S/C10H14N4O/c1-7-6-8(2)14-10(11-7)12-9(13-14)4-3-5-15/h6,15H,3-5H2,1-2H3
InChIKey
HNSUEZTWRUXEHD-UHFFFAOYSA-N
Compound name
3-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)propan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

206.11676 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.124036 146.4
[M+Na]+ 229.105978 158.3
[M-H]- 205.109484 145.3
[M+NH4]+ 224.150583 163.1
[M+K]+ 245.079918 154.2
[M+H-H2O]+ 189.114020 138.3
[M+HCOO]- 251.114961 166.1
[M+CH3COO]- 265.130611 185.5
[M+Na-2H]- 227.091426 152.6
[M]+ 206.11621142 150.5
[M]- 206.11730858 150.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.