CID 384367

Nsc674077

Structural Information

Molecular Formula
C16H19N3O
SMILES
CC1=CC=C(C=C1)N=NC2=CC(=C(C=C2)O)CN(C)C
InChI
InChI=1S/C16H19N3O/c1-12-4-6-14(7-5-12)17-18-15-8-9-16(20)13(10-15)11-19(2)3/h4-10,20H,11H2,1-3H3
InChIKey
SGMJQDSNLIVXDX-UHFFFAOYSA-N
Compound name
2-[(dimethylamino)methyl]-4-[(4-methylphenyl)diazenyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

269.1528 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.16008 163.2
[M+Na]+ 292.14202 170.0
[M-H]- 268.14552 172.9
[M+NH4]+ 287.18662 180.2
[M+K]+ 308.11596 167.8
[M+H-H2O]+ 252.15006 154.2
[M+HCOO]- 314.15100 192.3
[M+CH3COO]- 328.16665 212.9
[M+Na-2H]- 290.12747 168.7
[M]+ 269.15225 165.7
[M]- 269.15335 165.7
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.