CID 921158

N-(2,5-dimethylphenyl)-5,6-dihydro-4h-1,3-thiazin-2-amine

Structural Information

Molecular Formula
C12H16N2S
SMILES
CC1=CC(=C(C=C1)C)NC2=NCCCS2
InChI
InChI=1S/C12H16N2S/c1-9-4-5-10(2)11(8-9)14-12-13-6-3-7-15-12/h4-5,8H,3,6-7H2,1-2H3,(H,13,14)
InChIKey
AXBCMDYSVYIPKV-UHFFFAOYSA-N
Compound name
N-(2,5-dimethylphenyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

10
References

0
Patents

220.10342 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.11070 148.0
[M+Na]+ 243.09264 161.3
[M+NH4]+ 238.13724 157.9
[M+K]+ 259.06658 151.4
[M-H]- 219.09614 153.5
[M+Na-2H]- 241.07809 156.5
[M]+ 220.10287 152.0
[M]- 220.10397 152.0
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.