CID 472878

F4-mesh.

Structural Information

Molecular Formula
C20H22N4OS
SMILES
CC1CCC(=NNC(=O)CC2=CSC3=NC(=CN23)C4=CC=CC=C4)CC1
InChI
InChI=1S/C20H22N4OS/c1-14-7-9-16(10-8-14)22-23-19(25)11-17-13-26-20-21-18(12-24(17)20)15-5-3-2-4-6-15/h2-6,12-14H,7-11H2,1H3,(H,23,25)
InChIKey
UVVOIMPDOPPZOY-UHFFFAOYSA-N
Compound name
N-[(4-methylcyclohexylidene)amino]-2-(6-phenylimidazo[2,1-b][1,3]thiazol-3-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

366.15143 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 367.15871 185.8
[M+Na]+ 389.14065 192.8
[M-H]- 365.14415 195.6
[M+NH4]+ 384.18525 200.8
[M+K]+ 405.11459 187.2
[M+H-H2O]+ 349.14869 177.0
[M+HCOO]- 411.14963 204.0
[M+CH3COO]- 425.16528 196.1
[M+Na-2H]- 387.12610 184.8
[M]+ 366.15088 186.9
[M]- 366.15198 186.9
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.