CID 2734833

59483-84-0

Structural Information

Molecular Formula

C₁₃F₁₀O₃

SMILES

C1(=C(C(=C(C(=C1F)F)F)F)F)OC(=O)OC2=C(C(=C(C(=C2F)F)F)F)F

InChI

InChI=1S/C13F10O3/c14-1-3(16)7(20)11(8(21)4(1)17)25-13(24)26-12-9(22)5(18)2(15)6(19)10(12)23

InChIKey

IOVVFSGCNWQFQT-UHFFFAOYSA-N

Compound name

bis(2,3,4,5,6-pentafluorophenyl) carbonate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 3
References: 1663
Patents: 393.96878 Da
Monoisotopic Mass: 4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	394.97606	172.7
[M+Na]+	416.95800	189.0
[M-H]-	392.96150	169.4
[M+NH4]+	412.00260	185.2
[M+K]+	432.93194	182.9
[M+H-H2O]+	376.96604	157.7
[M+HCOO]-	438.96698	185.8
[M+CH3COO]-	452.98263	224.1
[M+Na-2H]-	414.94345	166.9
[M]+	393.96823	166.0
[M]-	393.96933	166.0

Literature stripe

literature stripe

Patent stripe

patents stripe