CID 44629867

4-azidocinnamaldehyde

Structural Information

Molecular Formula
C9H7N3O
SMILES
C1=CC(=CC=C1C=CC=O)N=[N+]=[N-]
InChI
InChI=1S/C9H7N3O/c10-12-11-9-5-3-8(4-6-9)2-1-7-13/h1-7H
InChIKey
MFGPIUGUWLAIGM-UHFFFAOYSA-N
Compound name
3-(4-azidophenyl)prop-2-enal
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

173.05891 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.06619 135.0
[M+Na]+ 196.04813 148.5
[M+NH4]+ 191.09273 143.7
[M+K]+ 212.02207 142.5
[M-H]- 172.05163 140.4
[M+Na-2H]- 194.03358 143.4
[M]+ 173.05836 138.2
[M]- 173.05946 138.2
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