CID 91981807

Furan, 2,3,3,4,4-pentafluorotetrahydro-5-methoxy-2,5-bis(1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl)-

Structural Information

Molecular Formula
C11H3F19O2
SMILES
COC1(C(C(C(O1)(C(C(F)(F)F)(C(F)(F)F)F)F)(F)F)(F)F)C(C(F)(F)F)(C(F)(F)F)F
InChI
InChI=1S/C11H3F19O2/c1-31-7(3(13,10(25,26)27)11(28,29)30)5(16,17)4(14,15)6(18,32-7)2(12,8(19,20)21)9(22,23)24/h1H3
InChIKey
YRGYOFYTTFLPQM-UHFFFAOYSA-N
Compound name
2,3,3,4,4-pentafluoro-2,5-bis(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-5-methoxyoxolane
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

107
Patents

527.983 Da
Monoisotopic Mass

6.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 528.99028 192.9
[M+Na]+ 550.97222 206.5
[M-H]- 526.97572 179.4
[M+NH4]+ 546.01682 205.7
[M+K]+ 566.94616 204.3
[M+H-H2O]+ 510.98026 181.7
[M+HCOO]- 572.98120 186.9
[M+CH3COO]- 586.99685 237.5
[M+Na-2H]- 548.95767 197.5
[M]+ 527.98245 168.5
[M]- 527.98355 168.5
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