CID 137951928

4-(1,1,2,2-tetrafluoro-2-methoxyethyl)benzaldehyde

Structural Information

Molecular Formula
C10H8F4O2
SMILES
COC(C(C1=CC=C(C=C1)C=O)(F)F)(F)F
InChI
InChI=1S/C10H8F4O2/c1-16-10(13,14)9(11,12)8-4-2-7(6-15)3-5-8/h2-6H,1H3
InChIKey
YOINXIXPJMEACS-UHFFFAOYSA-N
Compound name
4-(1,1,2,2-tetrafluoro-2-methoxyethyl)benzaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

236.04604 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.05332 157.6
[M+Na]+ 259.03526 165.1
[M+NH4]+ 254.07986 161.5
[M+K]+ 275.00920 160.5
[M-H]- 235.03876 152.4
[M+Na-2H]- 257.02071 160.3
[M]+ 236.04549 156.9
[M]- 236.04659 156.9
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.