CID 12256642

N-(3-azidophenyl)acetamide

Structural Information

Molecular Formula
C8H8N4O
SMILES
CC(=O)NC1=CC(=CC=C1)N=[N+]=[N-]
InChI
InChI=1S/C8H8N4O/c1-6(13)10-7-3-2-4-8(5-7)11-12-9/h2-5H,1H3,(H,10,13)
InChIKey
KPCSQULCFPNNDS-UHFFFAOYSA-N
Compound name
N-(3-azidophenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

176.06981 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.07709 133.0
[M+Na]+ 199.05903 139.5
[M-H]- 175.06253 139.6
[M+NH4]+ 194.10363 152.8
[M+K]+ 215.03297 134.0
[M+H-H2O]+ 159.06707 130.5
[M+HCOO]- 221.06801 165.1
[M+CH3COO]- 235.08366 185.3
[M+Na-2H]- 197.04448 143.6
[M]+ 176.06926 130.2
[M]- 176.07036 130.2
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

No patent data available for this compound.