CID 2404809

4-(chloromethyl)-n-(4-methylphenyl)-1,3-thiazol-2-amine hydrochloride

Structural Information

Molecular Formula
C11H11ClN2S
SMILES
CC1=CC=C(C=C1)NC2=NC(=CS2)CCl
InChI
InChI=1S/C11H11ClN2S/c1-8-2-4-9(5-3-8)13-11-14-10(6-12)7-15-11/h2-5,7H,6H2,1H3,(H,13,14)
InChIKey
TZIVPXFICWZCJM-UHFFFAOYSA-N
Compound name
4-(chloromethyl)-N-(4-methylphenyl)-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

238.03314 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.04042 150.4
[M+Na]+ 261.02236 164.4
[M+NH4]+ 256.06696 160.4
[M+K]+ 276.99630 155.7
[M-H]- 237.02586 155.3
[M+Na-2H]- 259.00781 158.8
[M]+ 238.03259 154.6
[M]- 238.03369 154.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.