CID 71742184

1408074-43-0

Structural Information

Molecular Formula
C10H17NO5
SMILES
CC(C)(C)OC(=O)NC(C1COC1)C(=O)O
InChI
InChI=1S/C10H17NO5/c1-10(2,3)16-9(14)11-7(8(12)13)6-4-15-5-6/h6-7H,4-5H2,1-3H3,(H,11,14)(H,12,13)
InChIKey
ZGLWUVSYEVUTKH-UHFFFAOYSA-N
Compound name
2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-(oxetan-3-yl)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

231.11067 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.117946 153.6
[M+Na]+ 254.099888 155.4
[M-H]- 230.103394 155.6
[M+NH4]+ 249.144493 162.1
[M+K]+ 270.073828 160.7
[M+H-H2O]+ 214.107930 142.1
[M+HCOO]- 276.108871 169.6
[M+CH3COO]- 290.124521 192.2
[M+Na-2H]- 252.085336 155.8
[M]+ 231.11012142 162.7
[M]- 231.11121858 162.7
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

patents stripe