CID 69928616

1232365-42-2

Structural Information

Molecular Formula
C10H17F2NO3
SMILES
CC(C)(C)OC(=O)NC1(CC(C1)(F)F)CO
InChI
InChI=1S/C10H17F2NO3/c1-8(2,3)16-7(15)13-9(6-14)4-10(11,12)5-9/h14H,4-6H2,1-3H3,(H,13,15)
InChIKey
RNZVBWMKWVRXIY-UHFFFAOYSA-N
Compound name
tert-butyl N-[3,3-difluoro-1-(hydroxymethyl)cyclobutyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

40
Patents

237.11765 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.12493 160.9
[M+Na]+ 260.10687 162.4
[M+NH4]+ 255.15147 164.1
[M+K]+ 276.08081 157.7
[M-H]- 236.11037 154.4
[M+Na-2H]- 258.09232 161.7
[M]+ 237.11710 158.0
[M]- 237.11820 158.0
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