CID 52333005

1181816-12-5

Structural Information

Molecular Formula
C11H17NO3
SMILES
CC(C)(C)OC(=O)N1CC2(C1)CC(=O)C2
InChI
InChI=1S/C11H17NO3/c1-10(2,3)15-9(14)12-6-11(7-12)4-8(13)5-11/h4-7H2,1-3H3
InChIKey
HQHRAGXKFOTSQE-UHFFFAOYSA-N
Compound name
tert-butyl 6-oxo-2-azaspiro[3.3]heptane-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

841
Patents

211.12085 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.12813 155.1
[M+Na]+ 234.11007 155.3
[M+NH4]+ 229.15467 155.0
[M+K]+ 250.08401 153.7
[M-H]- 210.11357 149.5
[M+Na-2H]- 232.09552 154.1
[M]+ 211.12030 151.3
[M]- 211.12140 151.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe