CID 136575898

2219370-91-7

Structural Information

Molecular Formula
C14H23NO4
SMILES
CC(C)(C)OC(=O)NC1CCC2(CC2)CC1C(=O)O
InChI
InChI=1S/C14H23NO4/c1-13(2,3)19-12(18)15-10-4-5-14(6-7-14)8-9(10)11(16)17/h9-10H,4-8H2,1-3H3,(H,15,18)(H,16,17)
InChIKey
KBQYPUNPDMBPCR-UHFFFAOYSA-N
Compound name
6-[(2-methylpropan-2-yl)oxycarbonylamino]spiro[2.5]octane-7-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

269.16272 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.17000 163.9
[M+Na]+ 292.15194 172.2
[M+NH4]+ 287.19654 171.8
[M+K]+ 308.12588 168.9
[M-H]- 268.15544 170.9
[M+Na-2H]- 290.13739 169.7
[M]+ 269.16217 168.0
[M]- 269.16327 168.0
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.