CID 550615

Bis(4-methacryloylthiophenyl) sulfide

Structural Information

Molecular Formula
C20H18O2S3
SMILES
CC(=C)C(=O)SC1=CC=C(C=C1)SC2=CC=C(C=C2)SC(=O)C(=C)C
InChI
InChI=1S/C20H18O2S3/c1-13(2)19(21)24-17-9-5-15(6-10-17)23-16-7-11-18(12-8-16)25-20(22)14(3)4/h5-12H,1,3H2,2,4H3
InChIKey
SPNAQSNLZHHUIJ-UHFFFAOYSA-N
Compound name
S-[4-[4-(2-methylprop-2-enoylsulfanyl)phenyl]sulfanylphenyl] 2-methylprop-2-enethioate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1440
Patents

386.0469 Da
Monoisotopic Mass

6.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 387.054176 185.8
[M+Na]+ 409.036118 190.9
[M-H]- 385.039624 190.3
[M+NH4]+ 404.080723 197.2
[M+K]+ 425.010058 182.1
[M+H-H2O]+ 369.044160 178.3
[M+HCOO]- 431.045101 188.2
[M+CH3COO]- 445.060751 217.5
[M+Na-2H]- 407.021566 181.1
[M]+ 386.04635142 187.5
[M]- 386.04744858 187.5
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