CID 216132

Cyclopropanecarboxylic acid, 2,2-bis(4-chlorophenyl)-, 2-(1-piperidinyl)ethyl ester, hydrochloride

Structural Information

Molecular Formula
C23H25Cl2NO2
SMILES
C1CCN(CC1)CCOC(=O)C2CC2(C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl
InChI
InChI=1S/C23H25Cl2NO2/c24-19-8-4-17(5-9-19)23(18-6-10-20(25)11-7-18)16-21(23)22(27)28-15-14-26-12-2-1-3-13-26/h4-11,21H,1-3,12-16H2
InChIKey
SZNNTXPMMLWTSZ-UHFFFAOYSA-N
Compound name
2-piperidin-1-ylethyl 2,2-bis(4-chlorophenyl)cyclopropane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

417.12622 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 418.13350 196.5
[M+Na]+ 440.11544 213.5
[M+NH4]+ 435.16004 207.0
[M+K]+ 456.08938 202.9
[M-H]- 416.11894 210.1
[M+Na-2H]- 438.10089 209.3
[M]+ 417.12567 204.8
[M]- 417.12677 204.8
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.