CID 83680162

1499480-13-5

Structural Information

Molecular Formula
C11H17NO3
SMILES
CC(C)(C)OC(=O)N1CC2CC2C(=O)C1
InChI
InChI=1S/C11H17NO3/c1-11(2,3)15-10(14)12-5-7-4-8(7)9(13)6-12/h7-8H,4-6H2,1-3H3
InChIKey
HABXLQPYOJUDMR-UHFFFAOYSA-N
Compound name
tert-butyl 5-oxo-3-azabicyclo[4.1.0]heptane-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

211.12085 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.12813 149.2
[M+Na]+ 234.11007 160.3
[M+NH4]+ 229.15467 156.8
[M+K]+ 250.08401 157.5
[M-H]- 210.11357 155.4
[M+Na-2H]- 232.09552 153.9
[M]+ 211.12030 153.4
[M]- 211.12140 153.4
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.