CID 107136

Benzperidine hydrochloride

Structural Information

Molecular Formula
C20H25NO
SMILES
C1CCNC(C1)CCOC(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C20H25NO/c1-3-9-17(10-4-1)20(18-11-5-2-6-12-18)22-16-14-19-13-7-8-15-21-19/h1-6,9-12,19-21H,7-8,13-16H2
InChIKey
WGWXUIWSCMMTSR-UHFFFAOYSA-N
Compound name
2-(2-benzhydryloxyethyl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.1936 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.20088 172.4
[M+Na]+ 318.18282 173.6
[M-H]- 294.18632 177.0
[M+NH4]+ 313.22742 184.0
[M+K]+ 334.15676 168.1
[M+H-H2O]+ 278.19086 162.1
[M+HCOO]- 340.19180 188.0
[M+CH3COO]- 354.20745 180.5
[M+Na-2H]- 316.16827 175.0
[M]+ 295.19305 165.7
[M]- 295.19415 165.7
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.