CID 3043860

3,4-diphenyl-6-methyl-4h-thiazolo(2,3-c)-as-triazine

Structural Information

Molecular Formula
C18H15N3S
SMILES
CC1=CSC2=NN=C(C(N12)C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C18H15N3S/c1-13-12-22-18-20-19-16(14-8-4-2-5-9-14)17(21(13)18)15-10-6-3-7-11-15/h2-12,17H,1H3
InChIKey
DIXHOBFDGBYNJQ-UHFFFAOYSA-N
Compound name
6-methyl-3,4-diphenyl-4H-[1,3]thiazolo[2,3-c][1,2,4]triazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

305.09866 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.10594 168.7
[M+Na]+ 328.08788 186.1
[M+NH4]+ 323.13248 178.8
[M+K]+ 344.06182 176.2
[M-H]- 304.09138 175.5
[M+Na-2H]- 326.07333 179.4
[M]+ 305.09811 173.9
[M]- 305.09921 173.9
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

No patent data available for this compound.