CID 45791314

Tert-butyl 1-(aminomethyl)-6-azaspiro[2.5]octane-6-carboxylate

Structural Information

Molecular Formula
C13H24N2O2
SMILES
CC(C)(C)OC(=O)N1CCC2(CC1)CC2CN
InChI
InChI=1S/C13H24N2O2/c1-12(2,3)17-11(16)15-6-4-13(5-7-15)8-10(13)9-14/h10H,4-9,14H2,1-3H3
InChIKey
KUFZKQLFEAITSM-UHFFFAOYSA-N
Compound name
tert-butyl 2-(aminomethyl)-6-azaspiro[2.5]octane-6-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

49
Patents

240.18378 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.191056 161.1
[M+Na]+ 263.172998 167.9
[M-H]- 239.176504 165.2
[M+NH4]+ 258.217603 174.7
[M+K]+ 279.146938 165.8
[M+H-H2O]+ 223.181040 155.5
[M+HCOO]- 285.181981 177.3
[M+CH3COO]- 299.197631 196.0
[M+Na-2H]- 261.158446 164.5
[M]+ 240.18323142 160.8
[M]- 240.18432858 160.8
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