CID 63645325

1342160-44-4

Structural Information

Molecular Formula
C9H15NO4
SMILES
CC(C)(C)C(C(=O)O)N1CCOC1=O
InChI
InChI=1S/C9H15NO4/c1-9(2,3)6(7(11)12)10-4-5-14-8(10)13/h6H,4-5H2,1-3H3,(H,11,12)
InChIKey
NRLJWJORFRZMIJ-UHFFFAOYSA-N
Compound name
3,3-dimethyl-2-(2-oxo-1,3-oxazolidin-3-yl)butanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

201.10011 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.10739 143.5
[M+Na]+ 224.08933 149.6
[M-H]- 200.09283 144.8
[M+NH4]+ 219.13393 161.0
[M+K]+ 240.06327 150.5
[M+H-H2O]+ 184.09737 138.5
[M+HCOO]- 246.09831 159.8
[M+CH3COO]- 260.11396 181.2
[M+Na-2H]- 222.07478 145.9
[M]+ 201.09956 143.4
[M]- 201.10066 143.4
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.