CID 200689

2-(4-methoxyphenyl)-4,5-dihydro-1,3-thiazole

Structural Information

Molecular Formula
C10H11NOS
SMILES
COC1=CC=C(C=C1)C2=NCCS2
InChI
InChI=1S/C10H11NOS/c1-12-9-4-2-8(3-5-9)10-11-6-7-13-10/h2-5H,6-7H2,1H3
InChIKey
LTOAZVNWZFZUCE-UHFFFAOYSA-N
Compound name
2-(4-methoxyphenyl)-4,5-dihydro-1,3-thiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

193.05614 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.06342 140.0
[M+Na]+ 216.04536 153.1
[M+NH4]+ 211.08996 150.0
[M+K]+ 232.01930 145.6
[M-H]- 192.04886 144.1
[M+Na-2H]- 214.03081 147.9
[M]+ 193.05559 143.6
[M]- 193.05669 143.6
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