CID 91812052

1955547-53-1

Structural Information

Molecular Formula
C15H25NO4
SMILES
CC(C)(C)OC(=O)N1CC(C2(C1)CCCCC2)C(=O)O
InChI
InChI=1S/C15H25NO4/c1-14(2,3)20-13(19)16-9-11(12(17)18)15(10-16)7-5-4-6-8-15/h11H,4-10H2,1-3H3,(H,17,18)
InChIKey
SRGGDRNFTIRXQP-UHFFFAOYSA-N
Compound name
2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azaspiro[4.5]decane-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

283.17834 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.185616 168.6
[M+Na]+ 306.167558 172.1
[M-H]- 282.171064 170.4
[M+NH4]+ 301.212163 186.3
[M+K]+ 322.141498 170.9
[M+H-H2O]+ 266.175600 163.3
[M+HCOO]- 328.176541 181.0
[M+CH3COO]- 342.192191 194.5
[M+Na-2H]- 304.153006 168.5
[M]+ 283.17779142 164.3
[M]- 283.17888858 164.3
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.