CID 1512646

120728-10-1

Structural Information

Molecular Formula
C10H17NO4
SMILES
CC(C)(C)OC(=O)NC1(CCC1)C(=O)O
InChI
InChI=1S/C10H17NO4/c1-9(2,3)15-8(14)11-10(7(12)13)5-4-6-10/h4-6H2,1-3H3,(H,11,14)(H,12,13)
InChIKey
ROVVUKFHORPDSM-UHFFFAOYSA-N
Compound name
1-[(2-methylpropan-2-yl)oxycarbonylamino]cyclobutane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

860
Patents

215.11575 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.12303 154.5
[M+Na]+ 238.10497 156.4
[M+NH4]+ 233.14957 157.1
[M+K]+ 254.07891 154.4
[M-H]- 214.10847 149.8
[M+Na-2H]- 236.09042 154.7
[M]+ 215.11520 151.9
[M]- 215.11630 151.9
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