CID 22479589

1824143-05-6

Structural Information

Molecular Formula
C11H17NO3
SMILES
CC(C)(C)OC(=O)NC1C2C1CC(=O)C2
InChI
InChI=1S/C11H17NO3/c1-11(2,3)15-10(14)12-9-7-4-6(13)5-8(7)9/h7-9H,4-5H2,1-3H3,(H,12,14)
InChIKey
YZWIMFNIJSUNNF-UHFFFAOYSA-N
Compound name
tert-butyl N-(3-oxo-6-bicyclo[3.1.0]hexanyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

211.12085 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.12813 147.1
[M+Na]+ 234.11007 156.2
[M-H]- 210.11357 152.5
[M+NH4]+ 229.15467 164.1
[M+K]+ 250.08401 153.2
[M+H-H2O]+ 194.11811 142.7
[M+HCOO]- 256.11905 167.8
[M+CH3COO]- 270.13470 191.8
[M+Na-2H]- 232.09552 151.0
[M]+ 211.12030 151.1
[M]- 211.12140 151.1
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