CID 4919

Procyclidine

Structural Information

Molecular Formula
C19H29NO
SMILES
C1CCC(CC1)C(CCN2CCCC2)(C3=CC=CC=C3)O
InChI
InChI=1S/C19H29NO/c21-19(17-9-3-1-4-10-17,18-11-5-2-6-12-18)13-16-20-14-7-8-15-20/h1,3-4,9-10,18,21H,2,5-8,11-16H2
InChIKey
WYDUSKDSKCASEF-UHFFFAOYSA-N
Compound name
1-cyclohexyl-1-phenyl-3-pyrrolidin-1-ylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
8
Annotation Hits

312
References

8189
Patents

287.2249 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.23218 172.4
[M+Na]+ 310.21412 172.7
[M-H]- 286.21762 177.0
[M+NH4]+ 305.25872 186.5
[M+K]+ 326.18806 168.2
[M+H-H2O]+ 270.22216 163.5
[M+HCOO]- 332.22310 185.8
[M+CH3COO]- 346.23875 197.0
[M+Na-2H]- 308.19957 172.7
[M]+ 287.22435 163.7
[M]- 287.22545 163.7
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

No patent data available for this compound.