CID 676722

90916-46-4

Structural Information

Molecular Formula
C10H10N2S
SMILES
CC1=CSC(=N1)NC2=CC=CC=C2
InChI
InChI=1S/C10H10N2S/c1-8-7-13-10(11-8)12-9-5-3-2-4-6-9/h2-7H,1H3,(H,11,12)
InChIKey
NTVCLKICUVTCND-UHFFFAOYSA-N
Compound name
4-methyl-N-phenyl-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

43
Patents

190.05647 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.06375 137.7
[M+Na]+ 213.04569 147.0
[M-H]- 189.04919 144.0
[M+NH4]+ 208.09029 158.4
[M+K]+ 229.01963 143.2
[M+H-H2O]+ 173.05373 130.9
[M+HCOO]- 235.05467 159.1
[M+CH3COO]- 249.07032 151.7
[M+Na-2H]- 211.03114 142.0
[M]+ 190.05592 138.9
[M]- 190.05702 138.9
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