CID 584437

4-(dimethylamino)phenylazoxybenzene

Structural Information

Molecular Formula
C14H15N3O
SMILES
CN(C)C1=CC=C(C=C1)N=[N+](C2=CC=CC=C2)[O-]
InChI
InChI=1S/C14H15N3O/c1-16(2)13-10-8-12(9-11-13)15-17(18)14-6-4-3-5-7-14/h3-11H,1-2H3
InChIKey
AVLLFBZLCFQWSX-UHFFFAOYSA-N
Compound name
[4-(dimethylamino)phenyl]imino-oxido-phenylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

241.1215 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.128776 153.4
[M+Na]+ 264.110718 158.3
[M-H]- 240.114224 162.5
[M+NH4]+ 259.155323 170.3
[M+K]+ 280.084658 152.4
[M+H-H2O]+ 224.118760 149.3
[M+HCOO]- 286.119701 182.5
[M+CH3COO]- 300.135351 197.8
[M+Na-2H]- 262.096166 161.9
[M]+ 241.12095142 151.9
[M]- 241.12204858 151.9
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