CID 207901

Brn 2155610

Structural Information

Molecular Formula
C22H31N3O
SMILES
CC(C)N(CCOC1=CC=C(C=C1)NC(=NC)C2=CC=CC=C2)C(C)C
InChI
InChI=1S/C22H31N3O/c1-17(2)25(18(3)4)15-16-26-21-13-11-20(12-14-21)24-22(23-5)19-9-7-6-8-10-19/h6-14,17-18H,15-16H2,1-5H3,(H,23,24)
InChIKey
MNYLMUSMYMFXJB-UHFFFAOYSA-N
Compound name
N-[4-[2-[di(propan-2-yl)amino]ethoxy]phenyl]-N'-methylbenzenecarboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

353.2467 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 354.253976 192.1
[M+Na]+ 376.235918 193.4
[M-H]- 352.239424 200.0
[M+NH4]+ 371.280523 204.8
[M+K]+ 392.209858 191.6
[M+H-H2O]+ 336.243960 181.9
[M+HCOO]- 398.244901 216.1
[M+CH3COO]- 412.260551 230.3
[M+Na-2H]- 374.221366 192.2
[M]+ 353.24615142 193.9
[M]- 353.24724858 193.9
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

No patent data available for this compound.