CID 2966629

5-methyl-n-(2-phenylethyl)-4,5-dihydro-1,3-thiazol-2-amine

Structural Information

Molecular Formula
C12H16N2S
SMILES
CC1CN=C(S1)NCCC2=CC=CC=C2
InChI
InChI=1S/C12H16N2S/c1-10-9-14-12(15-10)13-8-7-11-5-3-2-4-6-11/h2-6,10H,7-9H2,1H3,(H,13,14)
InChIKey
CGXLCYZPSOHWJJ-UHFFFAOYSA-N
Compound name
5-methyl-N-(2-phenylethyl)-4,5-dihydro-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

0
Patents

220.10342 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.11070 149.1
[M+Na]+ 243.09264 160.9
[M+NH4]+ 238.13724 158.7
[M+K]+ 259.06658 152.9
[M-H]- 219.09614 153.8
[M+Na-2H]- 241.07809 156.7
[M]+ 220.10287 152.5
[M]- 220.10397 152.5
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.