CID 148129

129050-99-3

Structural Information

Molecular Formula
C24H30N4O2
SMILES
CN1CCN=C1C2=CC=C(C=C2)OCCCCOC3=CC=C(C=C3)C4=NCCN4C
InChI
InChI=1S/C24H30N4O2/c1-27-15-13-25-23(27)19-5-9-21(10-6-19)29-17-3-4-18-30-22-11-7-20(8-12-22)24-26-14-16-28(24)2/h5-12H,3-4,13-18H2,1-2H3
InChIKey
DQARQWWIFDLJKS-UHFFFAOYSA-N
Compound name
1-methyl-2-[4-[4-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]butoxy]phenyl]-4,5-dihydroimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

406.23688 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 407.24416 199.7
[M+Na]+ 429.22610 205.2
[M-H]- 405.22960 207.0
[M+NH4]+ 424.27070 207.8
[M+K]+ 445.20004 199.3
[M+H-H2O]+ 389.23414 186.9
[M+HCOO]- 451.23508 216.8
[M+CH3COO]- 465.25073 207.7
[M+Na-2H]- 427.21155 196.1
[M]+ 406.23633 201.8
[M]- 406.23743 201.8
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.