CID 138040916

2243503-45-7

Structural Information

Molecular Formula
C15H25NO5
SMILES
CC(C)(C)OC(=O)N1CC2(CCC1C(=O)O)CCOCC2
InChI
InChI=1S/C15H25NO5/c1-14(2,3)21-13(19)16-10-15(6-8-20-9-7-15)5-4-11(16)12(17)18/h11H,4-10H2,1-3H3,(H,17,18)
InChIKey
DGJVVGRQOIIMPA-UHFFFAOYSA-N
Compound name
2-[(2-methylpropan-2-yl)oxycarbonyl]-9-oxa-2-azaspiro[5.5]undecane-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

299.17328 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 300.18056 169.6
[M+Na]+ 322.16250 172.2
[M-H]- 298.16600 171.7
[M+NH4]+ 317.20710 183.3
[M+K]+ 338.13644 172.8
[M+H-H2O]+ 282.17054 163.4
[M+HCOO]- 344.17148 179.1
[M+CH3COO]- 358.18713 197.6
[M+Na-2H]- 320.14795 172.0
[M]+ 299.17273 165.4
[M]- 299.17383 165.4
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.