CID 126970568

Tert-butyl 6-(methylamino)-2-azaspiro[3.3]heptane-2-carboxylate

Structural Information

Molecular Formula
C12H22N2O2
SMILES
CC(C)(C)OC(=O)N1CC2(C1)CC(C2)NC
InChI
InChI=1S/C12H22N2O2/c1-11(2,3)16-10(15)14-7-12(8-14)5-9(6-12)13-4/h9,13H,5-8H2,1-4H3
InChIKey
RNBAIEJDOGSDBC-UHFFFAOYSA-N
Compound name
tert-butyl 6-(methylamino)-2-azaspiro[3.3]heptane-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

33
Patents

226.16812 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.17540 152.9
[M+Na]+ 249.15734 155.6
[M-H]- 225.16084 156.6
[M+NH4]+ 244.20194 158.6
[M+K]+ 265.13128 160.7
[M+H-H2O]+ 209.16538 138.4
[M+HCOO]- 271.16632 167.9
[M+CH3COO]- 285.18197 203.2
[M+Na-2H]- 247.14279 156.3
[M]+ 226.16757 168.6
[M]- 226.16867 168.6
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

patents stripe