CID 113085

Thiazolo(5,4-d)thiazole, 2,5-bis(2-methoxyphenyl)-

Structural Information

Molecular Formula
C18H14N2O2S2
SMILES
COC1=CC=CC=C1C2=NC3=C(S2)N=C(S3)C4=CC=CC=C4OC
InChI
InChI=1S/C18H14N2O2S2/c1-21-13-9-5-3-7-11(13)15-19-17-18(23-15)20-16(24-17)12-8-4-6-10-14(12)22-2/h3-10H,1-2H3
InChIKey
CJCXSDJECXYLPM-UHFFFAOYSA-N
Compound name
2,5-bis(2-methoxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

354.04968 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 355.05696 179.4
[M+Na]+ 377.03890 193.2
[M-H]- 353.04240 189.8
[M+NH4]+ 372.08350 196.3
[M+K]+ 393.01284 187.1
[M+H-H2O]+ 337.04694 173.3
[M+HCOO]- 399.04788 195.1
[M+CH3COO]- 413.06353 192.3
[M+Na-2H]- 375.02435 178.9
[M]+ 354.04913 188.7
[M]- 354.05023 188.7
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