CID 120429

4h-1,3-thiazine, 5,6-dihydro-4,4-dimethyl-2-phenyl-

Structural Information

Molecular Formula
C12H15NS
SMILES
CC1(CCSC(=N1)C2=CC=CC=C2)C
InChI
InChI=1S/C12H15NS/c1-12(2)8-9-14-11(13-12)10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3
InChIKey
XODSHKNYWZYQAH-UHFFFAOYSA-N
Compound name
4,4-dimethyl-2-phenyl-5,6-dihydro-1,3-thiazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

205.09251 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.099786 143.1
[M+Na]+ 228.081728 150.9
[M-H]- 204.085234 148.5
[M+NH4]+ 223.126333 163.3
[M+K]+ 244.055668 147.3
[M+H-H2O]+ 188.089770 136.3
[M+HCOO]- 250.090711 159.0
[M+CH3COO]- 264.106361 155.8
[M+Na-2H]- 226.067176 147.7
[M]+ 205.09196142 142.1
[M]- 205.09305858 142.1
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

patents stripe