CID 141362323

Tert-butyl 1-azaspiro[3.3]heptane-1-carboxylate

Structural Information

Molecular Formula
C11H19NO2
SMILES
CC(C)(C)OC(=O)N1CCC12CCC2
InChI
InChI=1S/C11H19NO2/c1-10(2,3)14-9(13)12-8-7-11(12)5-4-6-11/h4-8H2,1-3H3
InChIKey
GQEFTZJBSRYDLQ-UHFFFAOYSA-N
Compound name
tert-butyl 1-azaspiro[3.3]heptane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

197.14159 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.14887 141.3
[M+Na]+ 220.13081 145.0
[M-H]- 196.13431 145.2
[M+NH4]+ 215.17541 148.5
[M+K]+ 236.10475 150.1
[M+H-H2O]+ 180.13885 128.0
[M+HCOO]- 242.13979 156.1
[M+CH3COO]- 256.15544 195.3
[M+Na-2H]- 218.11626 146.1
[M]+ 197.14104 157.3
[M]- 197.14214 157.3
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.