CID 135396753

2231675-68-4

Structural Information

Molecular Formula
C10H16FNO3
SMILES
CC(C)(C)OC(=O)NCC1(CC(=O)C1)F
InChI
InChI=1S/C10H16FNO3/c1-9(2,3)15-8(14)12-6-10(11)4-7(13)5-10/h4-6H2,1-3H3,(H,12,14)
InChIKey
ITTGKFJKNBXQAG-UHFFFAOYSA-N
Compound name
tert-butyl N-[(1-fluoro-3-oxocyclobutyl)methyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

217.11142 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.11870 149.6
[M+Na]+ 240.10064 154.8
[M-H]- 216.10414 151.9
[M+NH4]+ 235.14524 163.4
[M+K]+ 256.07458 157.4
[M+H-H2O]+ 200.10868 139.6
[M+HCOO]- 262.10962 168.6
[M+CH3COO]- 276.12527 191.9
[M+Na-2H]- 238.08609 153.7
[M]+ 217.11087 158.2
[M]- 217.11197 158.2
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.