CID 88056345

1232365-43-3

Structural Information

Molecular Formula
C10H15F2NO3
SMILES
CC(C)(C)OC(=O)NC1(CC(C1)(F)F)C=O
InChI
InChI=1S/C10H15F2NO3/c1-8(2,3)16-7(15)13-9(6-14)4-10(11,12)5-9/h6H,4-5H2,1-3H3,(H,13,15)
InChIKey
BSUSHTPSMGKZKK-UHFFFAOYSA-N
Compound name
tert-butyl N-(3,3-difluoro-1-formylcyclobutyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

74
Patents

235.102 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.10928 152.8
[M+Na]+ 258.09122 158.9
[M-H]- 234.09472 154.1
[M+NH4]+ 253.13582 167.8
[M+K]+ 274.06516 161.3
[M+H-H2O]+ 218.09926 143.5
[M+HCOO]- 280.10020 170.8
[M+CH3COO]- 294.11585 194.3
[M+Na-2H]- 256.07667 157.6
[M]+ 235.10145 160.6
[M]- 235.10255 160.6
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