CID 84075992

1262141-51-4

Structural Information

Molecular Formula
C10H17NO5
SMILES
CC(C)(C)OC(=O)NC1(CC(C1)O)C(=O)O
InChI
InChI=1S/C10H17NO5/c1-9(2,3)16-8(15)11-10(7(13)14)4-6(12)5-10/h6,12H,4-5H2,1-3H3,(H,11,15)(H,13,14)
InChIKey
HGZHBZBOYAISMT-UHFFFAOYSA-N
Compound name
3-hydroxy-1-[(2-methylpropan-2-yl)oxycarbonylamino]cyclobutane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

231.11067 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.117946 155.4
[M+Na]+ 254.099888 158.7
[M-H]- 230.103394 156.0
[M+NH4]+ 249.144493 166.8
[M+K]+ 270.073828 161.9
[M+H-H2O]+ 214.107930 146.0
[M+HCOO]- 276.108871 171.6
[M+CH3COO]- 290.124521 189.6
[M+Na-2H]- 252.085336 157.8
[M]+ 231.11012142 163.4
[M]- 231.11121858 163.4
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

patents stripe