CID 2330439

4h-1,3-thiazin-2-amine, n-(4-methylphenyl)-4,4,6-trimethyl-, monohydrochloride

Structural Information

Molecular Formula
C14H18N2S
SMILES
CC1=CC=C(C=C1)NC2=NC(C=C(S2)C)(C)C
InChI
InChI=1S/C14H18N2S/c1-10-5-7-12(8-6-10)15-13-16-14(3,4)9-11(2)17-13/h5-9H,1-4H3,(H,15,16)
InChIKey
DOPQIXFYZWGPJF-UHFFFAOYSA-N
Compound name
4,4,6-trimethyl-N-(4-methylphenyl)-1,3-thiazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

0
Patents

246.11906 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.12634 155.3
[M+Na]+ 269.10828 169.7
[M+NH4]+ 264.15288 166.4
[M+K]+ 285.08222 157.7
[M-H]- 245.11178 161.0
[M+Na-2H]- 267.09373 165.8
[M]+ 246.11851 159.8
[M]- 246.11961 159.8
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

No patent data available for this compound.