CID 72072

Dipiproverine hydrochloride

Structural Information

Molecular Formula
C20H30N2O2
SMILES
C1CCN(CC1)CCOC(=O)C(C2=CC=CC=C2)N3CCCCC3
InChI
InChI=1S/C20H30N2O2/c23-20(24-17-16-21-12-6-2-7-13-21)19(18-10-4-1-5-11-18)22-14-8-3-9-15-22/h1,4-5,10-11,19H,2-3,6-9,12-17H2
InChIKey
CGYQGGSMYNXXIV-UHFFFAOYSA-N
Compound name
2-piperidin-1-ylethyl 2-phenyl-2-piperidin-1-ylacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

910
Patents

330.23074 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 331.23802 182.9
[M+Na]+ 353.21996 181.3
[M-H]- 329.22346 186.3
[M+NH4]+ 348.26456 191.9
[M+K]+ 369.19390 177.7
[M+H-H2O]+ 313.22800 171.1
[M+HCOO]- 375.22894 193.6
[M+CH3COO]- 389.24459 207.6
[M+Na-2H]- 351.20541 181.7
[M]+ 330.23019 174.3
[M]- 330.23129 174.3
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

patents stripe