CID 4942

Propiverine

Structural Information

Molecular Formula
C23H29NO3
SMILES
CCCOC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)OC3CCN(CC3)C
InChI
InChI=1S/C23H29NO3/c1-3-18-26-23(19-10-6-4-7-11-19,20-12-8-5-9-13-20)22(25)27-21-14-16-24(2)17-15-21/h4-13,21H,3,14-18H2,1-2H3
InChIKey
QPCVHQBVMYCJOM-UHFFFAOYSA-N
Compound name
(1-methylpiperidin-4-yl) 2,2-diphenyl-2-propoxyacetate
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

244
References

7363
Patents

367.21475 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 368.22203 191.5
[M+Na]+ 390.20397 203.9
[M+NH4]+ 385.24857 198.5
[M+K]+ 406.17791 196.2
[M-H]- 366.20747 196.3
[M+Na-2H]- 388.18942 199.9
[M]+ 367.21420 194.7
[M]- 367.21530 194.7
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