CID 216118

37124-09-7

Structural Information

Molecular Formula
C22H25NO2
SMILES
C1CCN(C1)CCOC(=O)C2CC2(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C22H25NO2/c24-21(25-16-15-23-13-7-8-14-23)20-17-22(20,18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-6,9-12,20H,7-8,13-17H2
InChIKey
VOUJTHKEXGPKJD-UHFFFAOYSA-N
Compound name
2-pyrrolidin-1-ylethyl 2,2-diphenylcyclopropane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

335.18854 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 336.19582 179.9
[M+Na]+ 358.17776 185.7
[M-H]- 334.18126 190.6
[M+NH4]+ 353.22236 190.2
[M+K]+ 374.15170 181.5
[M+H-H2O]+ 318.18580 170.9
[M+HCOO]- 380.18674 199.6
[M+CH3COO]- 394.20239 189.6
[M+Na-2H]- 356.16321 180.9
[M]+ 335.18799 180.6
[M]- 335.18909 180.6
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.