CID 9953269

200398-40-9

Structural Information

Molecular Formula
C23H25FN4O2
SMILES
C1CN(CCC1C2=NOC3=C2C=CC(=C3)F)CCN4CCN(C4=O)C5=CC=CC=C5
InChI
InChI=1S/C23H25FN4O2/c24-18-6-7-20-21(16-18)30-25-22(20)17-8-10-26(11-9-17)12-13-27-14-15-28(23(27)29)19-4-2-1-3-5-19/h1-7,16-17H,8-15H2
InChIKey
ULCAXFRFGIKHRG-UHFFFAOYSA-N
Compound name
1-[2-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-3-phenylimidazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

4
References

21
Patents

408.19617 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 409.20345 200.8
[M+Na]+ 431.18539 214.3
[M+NH4]+ 426.22999 206.9
[M+K]+ 447.15933 210.1
[M-H]- 407.18889 206.2
[M+Na-2H]- 429.17084 206.6
[M]+ 408.19562 204.1
[M]- 408.19672 204.1
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