CID 138987555

2167234-97-9

Structural Information

Molecular Formula
C11H19NO5
SMILES
CC(C)(C)OC(=O)NCC1(CC(C1)C(=O)O)O
InChI
InChI=1S/C11H19NO5/c1-10(2,3)17-9(15)12-6-11(16)4-7(5-11)8(13)14/h7,16H,4-6H2,1-3H3,(H,12,15)(H,13,14)
InChIKey
HPTXEJJZIZTDON-UHFFFAOYSA-N
Compound name
3-hydroxy-3-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]cyclobutane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

245.12633 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 246.133606 160.0
[M+Na]+ 268.115548 162.9
[M-H]- 244.119054 160.4
[M+NH4]+ 263.160153 170.8
[M+K]+ 284.089488 165.9
[M+H-H2O]+ 228.123590 150.4
[M+HCOO]- 290.124531 175.9
[M+CH3COO]- 304.140181 192.5
[M+Na-2H]- 266.100996 161.9
[M]+ 245.12578142 168.4
[M]- 245.12687858 168.4
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.