CID 12152

Benzyl azide

Structural Information

Molecular Formula
C7H7N3
SMILES
C1=CC=C(C=C1)CN=[N+]=[N-]
InChI
InChI=1S/C7H7N3/c8-10-9-6-7-4-2-1-3-5-7/h1-5H,6H2
InChIKey
UDLLFLQFQMACJB-UHFFFAOYSA-N
Compound name
azidomethylbenzene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

56
References

3221
Patents

133.064 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.07128 124.2
[M+Na]+ 156.05322 138.1
[M+NH4]+ 151.09782 134.3
[M+K]+ 172.02716 132.1
[M-H]- 132.05672 130.7
[M+Na-2H]- 154.03867 134.1
[M]+ 133.06345 127.9
[M]- 133.06455 127.9
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