CID 4192643

116808-67-4

Structural Information

Molecular Formula
C19H17OS
SMILES
COC1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C19H17OS/c1-20-16-12-14-19(15-13-16)21(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-15H,1H3/q+1
InChIKey
CVBASHMCALKFME-UHFFFAOYSA-N
Compound name
(4-methoxyphenyl)-diphenylsulfanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5390
Patents

293.1 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.10728 162.6
[M+Na]+ 316.08922 181.6
[M+NH4]+ 311.13382 174.5
[M+K]+ 332.06316 170.4
[M-H]- 292.09272 172.7
[M+Na-2H]- 314.07467 176.7
[M]+ 293.09945 169.4
[M]- 293.10055 169.4
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