CID 150110

3-azidopropan-1-amine

Structural Information

Molecular Formula
C3H8N4
SMILES
C(CN)CN=[N+]=[N-]
InChI
InChI=1S/C3H8N4/c4-2-1-3-6-7-5/h1-4H2
InChIKey
OYBOVXXFJYJYPC-UHFFFAOYSA-N
Compound name
3-azidopropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

1365
Patents

100.0749 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 101.082176 114.9
[M+Na]+ 123.064118 121.5
[M-H]- 99.067624 117.7
[M+NH4]+ 118.108723 137.7
[M+K]+ 139.038058 117.6
[M+H-H2O]+ 83.072160 113.9
[M+HCOO]- 145.073101 146.9
[M+CH3COO]- 159.088751 172.1
[M+Na-2H]- 121.049566 126.1
[M]+ 100.07435142 111.4
[M]- 100.07544858 111.4
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

patents stripe