CID 121207833

Tert-butyl n-methyl-n-[(3-oxocyclobutyl)methyl]carbamate

Structural Information

Molecular Formula
C11H19NO3
SMILES
CC(C)(C)OC(=O)N(C)CC1CC(=O)C1
InChI
InChI=1S/C11H19NO3/c1-11(2,3)15-10(14)12(4)7-8-5-9(13)6-8/h8H,5-7H2,1-4H3
InChIKey
KMZMKIZYYCNSIA-UHFFFAOYSA-N
Compound name
tert-butyl N-methyl-N-[(3-oxocyclobutyl)methyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

213.13649 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.14377 150.1
[M+Na]+ 236.12571 154.2
[M-H]- 212.12921 154.7
[M+NH4]+ 231.17031 162.8
[M+K]+ 252.09965 158.3
[M+H-H2O]+ 196.13375 139.2
[M+HCOO]- 258.13469 170.4
[M+CH3COO]- 272.15034 196.1
[M+Na-2H]- 234.11116 152.4
[M]+ 213.13594 161.1
[M]- 213.13704 161.1
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

No patent data available for this compound.