CID 135392918

2227206-39-3

Structural Information

Molecular Formula
C14H23NO4
SMILES
CC(C)(C)OC(=O)N1CCC(CC12CC2)CC(=O)O
InChI
InChI=1S/C14H23NO4/c1-13(2,3)19-12(18)15-7-4-10(8-11(16)17)9-14(15)5-6-14/h10H,4-9H2,1-3H3,(H,16,17)
InChIKey
WKXDXUNHYYMETQ-UHFFFAOYSA-N
Compound name
2-[4-[(2-methylpropan-2-yl)oxycarbonyl]-4-azaspiro[2.5]octan-7-yl]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

269.16272 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.17000 166.7
[M+Na]+ 292.15194 173.3
[M-H]- 268.15544 169.8
[M+NH4]+ 287.19654 178.8
[M+K]+ 308.12588 171.4
[M+H-H2O]+ 252.15998 161.5
[M+HCOO]- 314.16092 180.2
[M+CH3COO]- 328.17657 196.4
[M+Na-2H]- 290.13739 168.9
[M]+ 269.16217 168.2
[M]- 269.16327 168.2
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.