CID 410937

1911-95-1

Structural Information

Molecular Formula
C18H15O
SMILES
CC1=CC(=CC(=[O+]1)C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C18H15O/c1-14-12-17(15-8-4-2-5-9-15)13-18(19-14)16-10-6-3-7-11-16/h2-13H,1H3/q+1
InChIKey
DLYSUUIMSFGXDL-UHFFFAOYSA-N
Compound name
2-methyl-4,6-diphenylpyrylium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

19
Patents

247.11229 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 248.11957 160.0
[M+Na]+ 270.10151 168.0
[M-H]- 246.10501 170.9
[M+NH4]+ 265.14611 175.3
[M+K]+ 286.07545 158.8
[M+H-H2O]+ 230.10955 154.2
[M+HCOO]- 292.11049 183.2
[M+CH3COO]- 306.12614 188.1
[M+Na-2H]- 268.08696 169.4
[M]+ 247.11174 159.4
[M]- 247.11284 159.4
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