CID 66701044

918644-73-2

Structural Information

Molecular Formula
C15H27NO3
SMILES
CC(C)(C)OC(=O)N1CCC2(CCC(CC2)O)CC1
InChI
InChI=1S/C15H27NO3/c1-14(2,3)19-13(18)16-10-8-15(9-11-16)6-4-12(17)5-7-15/h12,17H,4-11H2,1-3H3
InChIKey
NAFAKXTXWZJGHD-UHFFFAOYSA-N
Compound name
tert-butyl 9-hydroxy-3-azaspiro[5.5]undecane-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

92
Patents

269.1991 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.20638 167.0
[M+Na]+ 292.18832 169.7
[M-H]- 268.19182 168.3
[M+NH4]+ 287.23292 183.5
[M+K]+ 308.16226 168.1
[M+H-H2O]+ 252.19636 160.7
[M+HCOO]- 314.19730 177.7
[M+CH3COO]- 328.21295 192.9
[M+Na-2H]- 290.17377 169.0
[M]+ 269.19855 160.4
[M]- 269.19965 160.4
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

patents stripe