CID 23161

6699-13-4

Structural Information

Molecular Formula
C22H30N2O
SMILES
CC(C)C(CCCN1CCCC1)(C2=CC=CC3=CC=CC=C32)C(=O)N
InChI
InChI=1S/C22H30N2O/c1-17(2)22(21(23)25,13-8-16-24-14-5-6-15-24)20-12-7-10-18-9-3-4-11-19(18)20/h3-4,7,9-12,17H,5-6,8,13-16H2,1-2H3,(H2,23,25)
InChIKey
OVUBEDADYFNFEQ-UHFFFAOYSA-N
Compound name
2-naphthalen-1-yl-2-propan-2-yl-5-pyrrolidin-1-ylpentanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

338.2358 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 339.24308 186.5
[M+Na]+ 361.22502 188.8
[M-H]- 337.22852 190.6
[M+NH4]+ 356.26962 200.3
[M+K]+ 377.19896 183.9
[M+H-H2O]+ 321.23306 178.0
[M+HCOO]- 383.23400 201.7
[M+CH3COO]- 397.24965 215.4
[M+Na-2H]- 359.21047 186.0
[M]+ 338.23525 183.2
[M]- 338.23635 183.2
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.