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

8
Patents

231.11067 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.11795 153.6
[M+Na]+ 254.09989 155.4
[M-H]- 230.10339 155.6
[M+NH4]+ 249.14449 162.1
[M+K]+ 270.07383 160.7
[M+H-H2O]+ 214.10793 142.1
[M+HCOO]- 276.10887 169.6
[M+CH3COO]- 290.12452 192.2
[M+Na-2H]- 252.08534 155.8
[M]+ 231.11012 162.7
[M]- 231.11122 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