CID 110777

Dtxsid60976530

Structural Information

Molecular Formula
C12H16N2O
SMILES
CC1CC(C(=O)N1C2=CC=CC=C2)NC
InChI
InChI=1S/C12H16N2O/c1-9-8-11(13-2)12(15)14(9)10-6-4-3-5-7-10/h3-7,9,11,13H,8H2,1-2H3
InChIKey
FSENUEGUYFSISL-UHFFFAOYSA-N
Compound name
5-methyl-3-(methylamino)-1-phenylpyrrolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

204.12627 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.133546 145.3
[M+Na]+ 227.115488 152.9
[M-H]- 203.118994 150.9
[M+NH4]+ 222.160093 164.8
[M+K]+ 243.089428 149.8
[M+H-H2O]+ 187.123530 138.1
[M+HCOO]- 249.124471 168.4
[M+CH3COO]- 263.140121 188.7
[M+Na-2H]- 225.100936 148.3
[M]+ 204.12572142 143.3
[M]- 204.12681858 143.3
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.