CID 384372

Nsc674081

Structural Information

Molecular Formula
C18H24N4O
SMILES
CN(C)CC1=CC(=CC(=C1O)CN(C)C)N=NC2=CC=CC=C2
InChI
InChI=1S/C18H24N4O/c1-21(2)12-14-10-17(11-15(18(14)23)13-22(3)4)20-19-16-8-6-5-7-9-16/h5-11,23H,12-13H2,1-4H3
InChIKey
JCIFNCVBECKXEV-UHFFFAOYSA-N
Compound name
2,6-bis[(dimethylamino)methyl]-4-phenyldiazenylphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

312.195 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 313.20228 176.8
[M+Na]+ 335.18422 181.9
[M-H]- 311.18772 187.5
[M+NH4]+ 330.22882 192.3
[M+K]+ 351.15816 180.8
[M+H-H2O]+ 295.19226 166.7
[M+HCOO]- 357.19320 206.6
[M+CH3COO]- 371.20885 227.3
[M+Na-2H]- 333.16967 180.9
[M]+ 312.19445 180.5
[M]- 312.19555 180.5
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.