CID 165733465

2742656-36-4

Structural Information

Molecular Formula
C14H23NO5
SMILES
CC(C)(C)OC(=O)N1CCCC2(C1)CC(C2)(C(=O)O)O
InChI
InChI=1S/C14H23NO5/c1-12(2,3)20-11(18)15-6-4-5-13(9-15)7-14(19,8-13)10(16)17/h19H,4-9H2,1-3H3,(H,16,17)
InChIKey
HBLFPSYFQARGLL-UHFFFAOYSA-N
Compound name
2-hydroxy-6-[(2-methylpropan-2-yl)oxycarbonyl]-6-azaspiro[3.5]nonane-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

285.15762 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.164896 169.1
[M+Na]+ 308.146838 171.9
[M-H]- 284.150344 169.8
[M+NH4]+ 303.191443 179.6
[M+K]+ 324.120778 174.3
[M+H-H2O]+ 268.154880 160.0
[M+HCOO]- 330.155821 179.2
[M+CH3COO]- 344.171471 195.9
[M+Na-2H]- 306.132286 171.3
[M]+ 285.15707142 174.8
[M]- 285.15816858 174.8
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

patents stripe