CID 4061202

4-ethyl-2,6-diphenylpyrylium tetrafluoroborate

Structural Information

Molecular Formula
C19H17O
SMILES
CCC1=CC(=[O+]C(=C1)C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C19H17O/c1-2-15-13-18(16-9-5-3-6-10-16)20-19(14-15)17-11-7-4-8-12-17/h3-14H,2H2,1H3/q+1
InChIKey
CCPUGGXGWOGAHV-UHFFFAOYSA-N
Compound name
4-ethyl-2,6-diphenylpyrylium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

261.12793 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.13521 164.9
[M+Na]+ 284.11715 172.4
[M-H]- 260.12065 175.5
[M+NH4]+ 279.16175 179.6
[M+K]+ 300.09109 162.9
[M+H-H2O]+ 244.12519 158.8
[M+HCOO]- 306.12613 187.7
[M+CH3COO]- 320.14178 191.0
[M+Na-2H]- 282.10260 173.6
[M]+ 261.12738 164.6
[M]- 261.12848 164.6
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.