CID 83912090

4-[1-(3-chlorophenyl)cyclopropyl]piperidine hydrochloride

Structural Information

Molecular Formula
C14H18ClN
SMILES
C1CNCCC1C2(CC2)C3=CC(=CC=C3)Cl
InChI
InChI=1S/C14H18ClN/c15-13-3-1-2-12(10-13)14(6-7-14)11-4-8-16-9-5-11/h1-3,10-11,16H,4-9H2
InChIKey
YWJJYIUHNBSSSW-UHFFFAOYSA-N
Compound name
4-[1-(3-chlorophenyl)cyclopropyl]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

235.11278 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.12006 151.8
[M+Na]+ 258.10200 159.1
[M-H]- 234.10550 158.2
[M+NH4]+ 253.14660 165.0
[M+K]+ 274.07594 154.0
[M+H-H2O]+ 218.11004 144.6
[M+HCOO]- 280.11098 165.2
[M+CH3COO]- 294.12663 162.4
[M+Na-2H]- 256.08745 156.5
[M]+ 235.11223 149.1
[M]- 235.11333 149.1
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.