CID 165690261

2742656-92-2

Structural Information

Molecular Formula
C13H21NO5
SMILES
CC(C)(C)OC(=O)N1CCC2(C1)CC(C2)(C(=O)O)O
InChI
InChI=1S/C13H21NO5/c1-11(2,3)19-10(17)14-5-4-12(8-14)6-13(18,7-12)9(15)16/h18H,4-8H2,1-3H3,(H,15,16)
InChIKey
UHRZOUKPNOGDBU-UHFFFAOYSA-N
Compound name
2-hydroxy-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

271.14197 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.14925 164.5
[M+Na]+ 294.13119 168.3
[M-H]- 270.13469 166.0
[M+NH4]+ 289.17579 177.5
[M+K]+ 310.10513 170.4
[M+H-H2O]+ 254.13923 156.7
[M+HCOO]- 316.14017 177.1
[M+CH3COO]- 330.15582 192.5
[M+Na-2H]- 292.11664 166.3
[M]+ 271.14142 171.9
[M]- 271.14252 171.9
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.