CID 203234

14053-06-6

Structural Information

Molecular Formula
C15H20N2O
SMILES
CC1=C(C=CC(=C1)N2CCCC2)N3CCCC3=O
InChI
InChI=1S/C15H20N2O/c1-12-11-13(16-8-2-3-9-16)6-7-14(12)17-10-4-5-15(17)18/h6-7,11H,2-5,8-10H2,1H3
InChIKey
KBJUMPDYWJRBCA-UHFFFAOYSA-N
Compound name
1-(2-methyl-4-pyrrolidin-1-ylphenyl)pyrrolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

244.15756 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.164836 158.2
[M+Na]+ 267.146778 164.4
[M-H]- 243.150284 165.0
[M+NH4]+ 262.191383 176.2
[M+K]+ 283.120718 160.7
[M+H-H2O]+ 227.154820 149.6
[M+HCOO]- 289.155761 177.2
[M+CH3COO]- 303.171411 169.7
[M+Na-2H]- 265.132226 156.3
[M]+ 244.15701142 153.9
[M]- 244.15810858 153.9
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.