CID 118997511

1638767-04-0

Structural Information

Molecular Formula
C13H24N2O2
SMILES
CC(C)(C)OC(=O)N1CCCC12CC(C2)CN
InChI
InChI=1S/C13H24N2O2/c1-12(2,3)17-11(16)15-6-4-5-13(15)7-10(8-13)9-14/h10H,4-9,14H2,1-3H3
InChIKey
WDACZZFUFAIDOL-UHFFFAOYSA-N
Compound name
tert-butyl 2-(aminomethyl)-5-azaspiro[3.4]octane-5-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.18378 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.19106 159.8
[M+Na]+ 263.17300 163.2
[M-H]- 239.17650 163.0
[M+NH4]+ 258.21760 173.2
[M+K]+ 279.14694 164.8
[M+H-H2O]+ 223.18104 149.5
[M+HCOO]- 285.18198 176.0
[M+CH3COO]- 299.19763 195.6
[M+Na-2H]- 261.15845 161.0
[M]+ 240.18323 165.6
[M]- 240.18433 165.6
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.