CID 63645323

1343355-79-2

Structural Information

Molecular Formula
C10H17NO3
SMILES
CC(C)(C)C(C(=O)O)N1CCCC1=O
InChI
InChI=1S/C10H17NO3/c1-10(2,3)8(9(13)14)11-6-4-5-7(11)12/h8H,4-6H2,1-3H3,(H,13,14)
InChIKey
WOMAHGKEHKOOKD-UHFFFAOYSA-N
Compound name
3,3-dimethyl-2-(2-oxopyrrolidin-1-yl)butanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

199.12085 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.12813 145.7
[M+Na]+ 222.11007 151.5
[M-H]- 198.11357 146.3
[M+NH4]+ 217.15467 164.7
[M+K]+ 238.08401 150.8
[M+H-H2O]+ 182.11811 140.6
[M+HCOO]- 244.11905 162.4
[M+CH3COO]- 258.13470 182.0
[M+Na-2H]- 220.09552 146.5
[M]+ 199.12030 143.9
[M]- 199.12140 143.9
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.