CID 80723

4-methyl-6-(naphthylazo)benzene-1,3-diamine

Structural Information

Molecular Formula
C17H16N4
SMILES
CC1=CC(=C(C=C1N)N)N=NC2=CC=CC3=CC=CC=C32
InChI
InChI=1S/C17H16N4/c1-11-9-17(15(19)10-14(11)18)21-20-16-8-4-6-12-5-2-3-7-13(12)16/h2-10H,18-19H2,1H3
InChIKey
ISAXZYNEXMETQQ-UHFFFAOYSA-N
Compound name
4-methyl-6-(naphthalen-1-yldiazenyl)benzene-1,3-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

276.13748 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.14476 165.0
[M+Na]+ 299.12670 179.2
[M+NH4]+ 294.17130 174.5
[M+K]+ 315.10064 170.2
[M-H]- 275.13020 173.8
[M+Na-2H]- 297.11215 175.2
[M]+ 276.13693 169.5
[M]- 276.13803 169.5
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

patents stripe