CID 2735080

2-(4-methoxyphenyl)-4,6-diphenylpyrylium tetrafluoroborate

Structural Information

Molecular Formula
C24H19O2
SMILES
COC1=CC=C(C=C1)C2=CC(=CC(=[O+]2)C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C24H19O2/c1-25-22-14-12-20(13-15-22)24-17-21(18-8-4-2-5-9-18)16-23(26-24)19-10-6-3-7-11-19/h2-17H,1H3/q+1
InChIKey
OGIPOZUPFZCZIZ-UHFFFAOYSA-N
Compound name
2-(4-methoxyphenyl)-4,6-diphenylpyrylium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

74
Patents

339.13852 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 340.14580 188.8
[M+Na]+ 362.12774 195.8
[M-H]- 338.13124 202.1
[M+NH4]+ 357.17234 199.5
[M+K]+ 378.10168 185.5
[M+H-H2O]+ 322.13578 180.3
[M+HCOO]- 384.13672 210.7
[M+CH3COO]- 398.15237 205.3
[M+Na-2H]- 360.11319 195.8
[M]+ 339.13797 188.8
[M]- 339.13907 188.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe