CID 15767536

2-(chloromethoxy)-1,1,1-trifluoroethane

Structural Information

Molecular Formula
C3H4ClF3O
SMILES
C(C(F)(F)F)OCCl
InChI
InChI=1S/C3H4ClF3O/c4-2-8-1-3(5,6)7/h1-2H2
InChIKey
ROOXDWUGQRXXDK-UHFFFAOYSA-N
Compound name
2-(chloromethoxy)-1,1,1-trifluoroethane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

147.99028 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.99756 119.4
[M+Na]+ 170.97950 129.2
[M-H]- 146.98300 116.2
[M+NH4]+ 166.02410 141.7
[M+K]+ 186.95344 127.2
[M+H-H2O]+ 130.98754 114.1
[M+HCOO]- 192.98848 135.2
[M+CH3COO]- 207.00413 172.1
[M+Na-2H]- 168.96495 126.7
[M]+ 147.98973 118.5
[M]- 147.99083 118.5
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