CID 129964150

Tert-butyl 6-(aminomethyl)-5-oxa-2-azaspiro[3.5]nonane-2-carboxylate

Structural Information

Molecular Formula
C13H24N2O3
SMILES
CC(C)(C)OC(=O)N1CC2(C1)CCCC(O2)CN
InChI
InChI=1S/C13H24N2O3/c1-12(2,3)18-11(16)15-8-13(9-15)6-4-5-10(7-14)17-13/h10H,4-9,14H2,1-3H3
InChIKey
DMYDETRMQVZCEQ-UHFFFAOYSA-N
Compound name
tert-butyl 6-(aminomethyl)-5-oxa-2-azaspiro[3.5]nonane-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.17868 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.18596 160.8
[M+Na]+ 279.16790 163.5
[M-H]- 255.17140 164.1
[M+NH4]+ 274.21250 170.4
[M+K]+ 295.14184 167.1
[M+H-H2O]+ 239.17594 149.5
[M+HCOO]- 301.17688 174.3
[M+CH3COO]- 315.19253 198.1
[M+Na-2H]- 277.15335 164.3
[M]+ 256.17813 166.6
[M]- 256.17923 166.6
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.