CID 71157

Nefiracetam

Structural Information

Molecular Formula
C14H18N2O2
SMILES
CC1=C(C(=CC=C1)C)NC(=O)CN2CCCC2=O
InChI
InChI=1S/C14H18N2O2/c1-10-5-3-6-11(2)14(10)15-12(17)9-16-8-4-7-13(16)18/h3,5-6H,4,7-9H2,1-2H3,(H,15,17)
InChIKey
NGHTXZCKLWZPGK-UHFFFAOYSA-N
Compound name
N-(2,6-dimethylphenyl)-2-(2-oxopyrrolidin-1-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

162
References

2217
Patents

246.13683 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.14411 156.9
[M+Na]+ 269.12605 163.5
[M-H]- 245.12955 162.4
[M+NH4]+ 264.17065 174.6
[M+K]+ 285.09999 160.5
[M+H-H2O]+ 229.13409 149.4
[M+HCOO]- 291.13503 178.8
[M+CH3COO]- 305.15068 196.2
[M+Na-2H]- 267.11150 157.7
[M]+ 246.13628 155.7
[M]- 246.13738 155.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe