CID 165676627

2408963-51-7

Structural Information

Molecular Formula
C14H23NO4
SMILES
CC(C)(C)OC(=O)N1CC(CCC12CCC2)C(=O)O
InChI
InChI=1S/C14H23NO4/c1-13(2,3)19-12(18)15-9-10(11(16)17)5-8-14(15)6-4-7-14/h10H,4-9H2,1-3H3,(H,16,17)
InChIKey
JRMYDXVUHUBHIX-UHFFFAOYSA-N
Compound name
5-[(2-methylpropan-2-yl)oxycarbonyl]-5-azaspiro[3.5]nonane-7-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

269.16272 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.17000 164.0
[M+Na]+ 292.15194 166.6
[M-H]- 268.15544 165.8
[M+NH4]+ 287.19654 174.0
[M+K]+ 308.12588 169.0
[M+H-H2O]+ 252.15998 153.5
[M+HCOO]- 314.16092 175.6
[M+CH3COO]- 328.17657 196.4
[M+Na-2H]- 290.13739 165.4
[M]+ 269.16217 169.7
[M]- 269.16327 169.7
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

No patent data available for this compound.