CID 132327681

2126159-86-0

Structural Information

Molecular Formula
C14H20N2O4
SMILES
CC(C)(C)OC(=O)N1CC(C2(C1)CC(C2)C(=O)O)C#N
InChI
InChI=1S/C14H20N2O4/c1-13(2,3)20-12(19)16-7-10(6-15)14(8-16)4-9(5-14)11(17)18/h9-10H,4-5,7-8H2,1-3H3,(H,17,18)
InChIKey
QBQFXGWCPCMRFW-UHFFFAOYSA-N
Compound name
8-cyano-6-[(2-methylpropan-2-yl)oxycarbonyl]-6-azaspiro[3.4]octane-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

280.1423 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.14958 166.0
[M+Na]+ 303.13152 168.3
[M+NH4]+ 298.17612 165.4
[M+K]+ 319.10546 164.6
[M-H]- 279.13502 154.7
[M+Na-2H]- 301.11697 163.0
[M]+ 280.14175 161.0
[M]- 280.14285 161.0
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.