CID 207898

N-(p-(2-(diethylamino)ethoxy)phenyl)-n'-phenyl-benzamidine oxalate

Structural Information

Molecular Formula
C25H29N3O
SMILES
CCN(CC)CCOC1=CC=C(C=C1)N=C(C2=CC=CC=C2)NC3=CC=CC=C3
InChI
InChI=1S/C25H29N3O/c1-3-28(4-2)19-20-29-24-17-15-23(16-18-24)27-25(21-11-7-5-8-12-21)26-22-13-9-6-10-14-22/h5-18H,3-4,19-20H2,1-2H3,(H,26,27)
InChIKey
ZANIXEJAIMUJOP-UHFFFAOYSA-N
Compound name
N'-[4-[2-(diethylamino)ethoxy]phenyl]-N-phenylbenzenecarboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

387.23105 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 388.23833 200.4
[M+Na]+ 410.22027 213.5
[M+NH4]+ 405.26487 208.4
[M+K]+ 426.19421 203.3
[M-H]- 386.22377 209.5
[M+Na-2H]- 408.20572 211.8
[M]+ 387.23050 204.9
[M]- 387.23160 204.9
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.