CID 3048938

1-acetyl-1'-benzylspiro(indoline-3,3'-pyrrolidine) oxalate

Structural Information

Molecular Formula
C20H22N2O
SMILES
CC(=O)N1CC2(CCN(C2)CC3=CC=CC=C3)C4=CC=CC=C41
InChI
InChI=1S/C20H22N2O/c1-16(23)22-15-20(18-9-5-6-10-19(18)22)11-12-21(14-20)13-17-7-3-2-4-8-17/h2-10H,11-15H2,1H3
InChIKey
LDZNJHQPEYNJFJ-UHFFFAOYSA-N
Compound name
1-(1'-benzylspiro[2H-indole-3,3'-pyrrolidine]-1-yl)ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

306.17322 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.18050 175.1
[M+Na]+ 329.16244 187.6
[M+NH4]+ 324.20704 185.4
[M+K]+ 345.13638 181.2
[M-H]- 305.16594 179.5
[M+Na-2H]- 327.14789 182.7
[M]+ 306.17267 178.3
[M]- 306.17377 178.3
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.