CID 2303422

4,4'-[naphthalene-2,7-diylbis(oxy)]dianiline

Structural Information

Molecular Formula
C22H18N2O2
SMILES
C1=CC(=CC2=C1C=CC(=C2)OC3=CC=C(C=C3)N)OC4=CC=C(C=C4)N
InChI
InChI=1S/C22H18N2O2/c23-17-3-9-19(10-4-17)25-21-7-1-15-2-8-22(14-16(15)13-21)26-20-11-5-18(24)6-12-20/h1-14H,23-24H2
InChIKey
NGHVXWLOTSZENC-UHFFFAOYSA-N
Compound name
4-[7-(4-aminophenoxy)naphthalen-2-yl]oxyaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

129
Patents

342.13684 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.14412 180.6
[M+Na]+ 365.12606 188.0
[M-H]- 341.12956 190.4
[M+NH4]+ 360.17066 193.3
[M+K]+ 381.10000 181.9
[M+H-H2O]+ 325.13410 170.4
[M+HCOO]- 387.13504 204.1
[M+CH3COO]- 401.15069 191.2
[M+Na-2H]- 363.11151 186.0
[M]+ 342.13629 179.5
[M]- 342.13739 179.5
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