CID 165142103

Tert-butyl 10-(hydroxymethyl)-7-azaspiro[4.5]decane-7-carboxylate

Structural Information

Molecular Formula
C15H27NO3
SMILES
CC(C)(C)OC(=O)N1CCC(C2(C1)CCCC2)CO
InChI
InChI=1S/C15H27NO3/c1-14(2,3)19-13(18)16-9-6-12(10-17)15(11-16)7-4-5-8-15/h12,17H,4-11H2,1-3H3
InChIKey
WMGCLPXUAWMSOI-UHFFFAOYSA-N
Compound name
tert-butyl 10-(hydroxymethyl)-7-azaspiro[4.5]decane-7-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

269.1991 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.206376 167.8
[M+Na]+ 292.188318 171.4
[M-H]- 268.191824 169.5
[M+NH4]+ 287.232923 186.3
[M+K]+ 308.162258 169.5
[M+H-H2O]+ 252.196360 162.2
[M+HCOO]- 314.197301 180.7
[M+CH3COO]- 328.212951 192.3
[M+Na-2H]- 290.173766 168.4
[M]+ 269.19855142 163.2
[M]- 269.19964858 163.2
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