CID 2782463

1,2-bis(1,1,2,2-tetrafluoroethoxy)benzene

Structural Information

Molecular Formula
C10H6F8O2
SMILES
C1=CC=C(C(=C1)OC(C(F)F)(F)F)OC(C(F)F)(F)F
InChI
InChI=1S/C10H6F8O2/c11-7(12)9(15,16)19-5-3-1-2-4-6(5)20-10(17,18)8(13)14/h1-4,7-8H
InChIKey
TYMCPUUDTMKLGP-UHFFFAOYSA-N
Compound name
1,2-bis(1,1,2,2-tetrafluoroethoxy)benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

33
Patents

310.02402 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 311.03130 157.0
[M+Na]+ 333.01324 165.6
[M-H]- 309.01674 150.5
[M+NH4]+ 328.05784 171.1
[M+K]+ 348.98718 162.8
[M+H-H2O]+ 293.02128 144.6
[M+HCOO]- 355.02222 167.7
[M+CH3COO]- 369.03787 204.8
[M+Na-2H]- 330.99869 158.2
[M]+ 310.02347 148.0
[M]- 310.02457 148.0
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