CID 12908108

1-azidopropan-2-ol

Structural Information

Molecular Formula
C3H7N3O
SMILES
CC(CN=[N+]=[N-])O
InChI
InChI=1S/C3H7N3O/c1-3(7)2-5-6-4/h3,7H,2H2,1H3
InChIKey
YKPFXAHKQLQHCJ-UHFFFAOYSA-N
Compound name
1-azidopropan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

131
Patents

101.058914 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 102.066190 116.1
[M+Na]+ 124.048132 122.9
[M-H]- 100.051638 118.2
[M+NH4]+ 119.092737 138.7
[M+K]+ 140.022072 119.3
[M+H-H2O]+ 84.056174 115.8
[M+HCOO]- 146.057115 145.5
[M+CH3COO]- 160.072765 167.8
[M+Na-2H]- 122.033580 126.3
[M]+ 101.05836542 113.2
[M]- 101.05946258 113.2
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

patents stripe