CID 82667310

Tert-butyl 7-amino-3-azaspiro[5.5]undecane-3-carboxylate

Structural Information

Molecular Formula
C15H28N2O2
SMILES
CC(C)(C)OC(=O)N1CCC2(CCCCC2N)CC1
InChI
InChI=1S/C15H28N2O2/c1-14(2,3)19-13(18)17-10-8-15(9-11-17)7-5-4-6-12(15)16/h12H,4-11,16H2,1-3H3
InChIKey
WEUMGGHBUJIBNR-UHFFFAOYSA-N
Compound name
tert-butyl 11-amino-3-azaspiro[5.5]undecane-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

268.2151 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.22238 167.3
[M+Na]+ 291.20432 169.7
[M-H]- 267.20782 169.4
[M+NH4]+ 286.24892 184.0
[M+K]+ 307.17826 168.0
[M+H-H2O]+ 251.21236 160.5
[M+HCOO]- 313.21330 179.8
[M+CH3COO]- 327.22895 197.7
[M+Na-2H]- 289.18977 169.0
[M]+ 268.21455 159.3
[M]- 268.21565 159.3
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.