CID 21141124

(s)-n,n-dimethyl-5-oxopyrrolidine-2-carboxamide

Structural Information

Molecular Formula
C7H12N2O2
SMILES
CN(C)C(=O)[C@@H]1CCC(=O)N1
InChI
InChI=1S/C7H12N2O2/c1-9(2)7(11)5-3-4-6(10)8-5/h5H,3-4H2,1-2H3,(H,8,10)/t5-/m0/s1
InChIKey
XANBEQKZEYIHTQ-YFKPBYRVSA-N
Compound name
(2S)-N,N-dimethyl-5-oxopyrrolidine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

13
Patents

156.08987 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.097146 133.5
[M+Na]+ 179.079088 139.7
[M-H]- 155.082594 135.6
[M+NH4]+ 174.123693 154.4
[M+K]+ 195.053028 139.6
[M+H-H2O]+ 139.087130 127.4
[M+HCOO]- 201.088071 155.1
[M+CH3COO]- 215.103721 178.0
[M+Na-2H]- 177.064536 135.6
[M]+ 156.08932142 130.7
[M]- 156.09041858 130.7
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.