CID 584035

4-azido-n,n-dimethylaniline

Structural Information

Molecular Formula
C8H10N4
SMILES
CN(C)C1=CC=C(C=C1)N=[N+]=[N-]
InChI
InChI=1S/C8H10N4/c1-12(2)8-5-3-7(4-6-8)10-11-9/h3-6H,1-2H3
InChIKey
BKQJWJKRVJLLFK-UHFFFAOYSA-N
Compound name
4-azido-N,N-dimethylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

162.09055 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.09783 131.0
[M+Na]+ 185.07977 137.6
[M-H]- 161.08327 138.9
[M+NH4]+ 180.12437 152.1
[M+K]+ 201.05371 133.2
[M+H-H2O]+ 145.08781 128.3
[M+HCOO]- 207.08875 164.1
[M+CH3COO]- 221.10440 187.9
[M+Na-2H]- 183.06522 141.8
[M]+ 162.09000 129.5
[M]- 162.09110 129.5
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