CID 137952264

2219369-17-0

Structural Information

Molecular Formula
C11H17F2NO4
SMILES
CC(C)(C)OC(=O)NC1(CC(C1)C(F)F)C(=O)O
InChI
InChI=1S/C11H17F2NO4/c1-10(2,3)18-9(17)14-11(8(15)16)4-6(5-11)7(12)13/h6-7H,4-5H2,1-3H3,(H,14,17)(H,15,16)
InChIKey
QIRXVROWFKQQGJ-UHFFFAOYSA-N
Compound name
3-(difluoromethyl)-1-[(2-methylpropan-2-yl)oxycarbonylamino]cyclobutane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

265.11258 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.11986 170.8
[M+Na]+ 288.10180 170.8
[M+NH4]+ 283.14640 171.3
[M+K]+ 304.07574 169.0
[M-H]- 264.10530 162.9
[M+Na-2H]- 286.08725 168.3
[M]+ 265.11203 166.9
[M]- 265.11313 166.9
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