CID 76078

1-naphthalenamine, 4-(1-naphthalenylazo)-

Structural Information

Molecular Formula
C20H15N3
SMILES
C1=CC=C2C(=C1)C=CC=C2N=NC3=CC=C(C4=CC=CC=C43)N
InChI
InChI=1S/C20H15N3/c21-18-12-13-20(17-10-4-3-9-16(17)18)23-22-19-11-5-7-14-6-1-2-8-15(14)19/h1-13H,21H2
InChIKey
SILZUVHOJDAKAS-UHFFFAOYSA-N
Compound name
4-(naphthalen-1-yldiazenyl)naphthalen-1-amine
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

228
Patents

297.1266 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.13388 165.9
[M+Na]+ 320.11582 175.1
[M-H]- 296.11932 176.8
[M+NH4]+ 315.16042 183.2
[M+K]+ 336.08976 169.0
[M+H-H2O]+ 280.12386 156.1
[M+HCOO]- 342.12480 194.5
[M+CH3COO]- 356.14045 178.7
[M+Na-2H]- 318.10127 177.1
[M]+ 297.12605 166.9
[M]- 297.12715 166.9
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