CID 121552731

Tert-butyl 4-hydroxy-1-azaspiro[4.4]nonane-1-carboxylate

Structural Information

Molecular Formula
C13H23NO3
SMILES
CC(C)(C)OC(=O)N1CCC(C12CCCC2)O
InChI
InChI=1S/C13H23NO3/c1-12(2,3)17-11(16)14-9-6-10(15)13(14)7-4-5-8-13/h10,15H,4-9H2,1-3H3
InChIKey
WDPCWAUAPKJGQB-UHFFFAOYSA-N
Compound name
tert-butyl 4-hydroxy-1-azaspiro[4.4]nonane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

241.1678 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.17508 160.0
[M+Na]+ 264.15702 165.2
[M-H]- 240.16052 162.6
[M+NH4]+ 259.20162 181.5
[M+K]+ 280.13096 163.9
[M+H-H2O]+ 224.16506 155.4
[M+HCOO]- 286.16600 175.8
[M+CH3COO]- 300.18165 186.2
[M+Na-2H]- 262.14247 160.4
[M]+ 241.16725 156.9
[M]- 241.16835 156.9
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.