CID 3805326

374096-46-5

Structural Information

Molecular Formula
C20H19ClN2OS
SMILES
C1CC(OC1)CN2C(=CSC2=NC3=CC=CC=C3)C4=CC=C(C=C4)Cl
InChI
InChI=1S/C20H19ClN2OS/c21-16-10-8-15(9-11-16)19-14-25-20(22-17-5-2-1-3-6-17)23(19)13-18-7-4-12-24-18/h1-3,5-6,8-11,14,18H,4,7,12-13H2
InChIKey
HZDJXFMKBTWMHC-UHFFFAOYSA-N
Compound name
4-(4-chlorophenyl)-3-(oxolan-2-ylmethyl)-N-phenyl-1,3-thiazol-2-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

370.09067 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 371.09795 185.4
[M+Na]+ 393.07989 200.7
[M+NH4]+ 388.12449 195.4
[M+K]+ 409.05383 192.4
[M-H]- 369.08339 195.5
[M+Na-2H]- 391.06534 195.6
[M]+ 370.09012 191.4
[M]- 370.09122 191.4
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

No patent data available for this compound.