CID 9570758

N-(benzamidomethyl)-3-methyl-2-thiazolidinimine

Structural Information

Molecular Formula
C12H15N3OS
SMILES
CN\1CCS/C1=N/CNC(=O)C2=CC=CC=C2
InChI
InChI=1S/C12H15N3OS/c1-15-7-8-17-12(15)14-9-13-11(16)10-5-3-2-4-6-10/h2-6H,7-9H2,1H3,(H,13,16)/b14-12+
InChIKey
JHHMVVNOKBCEEO-WYMLVPIESA-N
Compound name
N-[[(E)-(3-methyl-1,3-thiazolidin-2-ylidene)amino]methyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

249.09358 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.10086 156.5
[M+Na]+ 272.08280 165.7
[M+NH4]+ 267.12740 164.6
[M+K]+ 288.05674 159.2
[M-H]- 248.08630 160.4
[M+Na-2H]- 270.06825 162.6
[M]+ 249.09303 159.0
[M]- 249.09413 159.0
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.