CID 100889

2-naphthalenamine, n-(2-ethylhexyl)-1-(phenylazo)-

Structural Information

Molecular Formula
C24H29N3
SMILES
CCCCC(CC)CNC1=C(C2=CC=CC=C2C=C1)N=NC3=CC=CC=C3
InChI
InChI=1S/C24H29N3/c1-3-5-11-19(4-2)18-25-23-17-16-20-12-9-10-15-22(20)24(23)27-26-21-13-7-6-8-14-21/h6-10,12-17,19,25H,3-5,11,18H2,1-2H3
InChIKey
MQMJIQSDNNCBRS-UHFFFAOYSA-N
Compound name
N-(2-ethylhexyl)-1-phenyldiazenylnaphthalen-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

359.23615 Da
Monoisotopic Mass

8.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 360.24343 189.9
[M+Na]+ 382.22537 193.6
[M-H]- 358.22887 198.6
[M+NH4]+ 377.26997 203.6
[M+K]+ 398.19931 188.3
[M+H-H2O]+ 342.23341 179.2
[M+HCOO]- 404.23435 215.7
[M+CH3COO]- 418.25000 230.9
[M+Na-2H]- 380.21082 195.3
[M]+ 359.23560 192.0
[M]- 359.23670 192.0
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.