CID 575257

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

Structural Information

Molecular Formula
C14H18N2OS
SMILES
CC1=CC(N=C(S1)NC2=CC=C(C=C2)OC)(C)C
InChI
InChI=1S/C14H18N2OS/c1-10-9-14(2,3)16-13(18-10)15-11-5-7-12(17-4)8-6-11/h5-9H,1-4H3,(H,15,16)
InChIKey
GSJGXBKFHMCPFS-UHFFFAOYSA-N
Compound name
N-(4-methoxyphenyl)-4,4,6-trimethyl-1,3-thiazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

262.11398 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.12126 157.5
[M+Na]+ 285.10320 166.2
[M-H]- 261.10670 163.4
[M+NH4]+ 280.14780 175.7
[M+K]+ 301.07714 162.2
[M+H-H2O]+ 245.11124 150.2
[M+HCOO]- 307.11218 175.3
[M+CH3COO]- 321.12783 197.8
[M+Na-2H]- 283.08865 161.4
[M]+ 262.11343 160.1
[M]- 262.11453 160.1
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.