CID 2382939

102026-45-9

Structural Information

Molecular Formula
C17H16N2S
SMILES
CC1=CC=C(C=C1)C2=C(SC(=N2)N)C3=CC=C(C=C3)C
InChI
InChI=1S/C17H16N2S/c1-11-3-7-13(8-4-11)15-16(20-17(18)19-15)14-9-5-12(2)6-10-14/h3-10H,1-2H3,(H2,18,19)
InChIKey
DLANDBNUPHBVOL-UHFFFAOYSA-N
Compound name
4,5-bis(4-methylphenyl)-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

3
Patents

280.10342 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.11070 164.6
[M+Na]+ 303.09264 180.1
[M+NH4]+ 298.13724 174.5
[M+K]+ 319.06658 171.1
[M-H]- 279.09614 172.2
[M+Na-2H]- 301.07809 174.9
[M]+ 280.10287 169.7
[M]- 280.10397 169.7
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