CID 2807521

Hms1662f07

Structural Information

Molecular Formula

C₁₀H₁₅N₃S

SMILES

CC1=CSC(=N1)NN=C2CCCCC2

InChI

InChI=1S/C10H15N3S/c1-8-7-14-10(11-8)13-12-9-5-3-2-4-6-9/h7H,2-6H2,1H3,(H,11,13)

InChIKey

DUXJPESAETZJST-UHFFFAOYSA-N

Compound name

N-(cyclohexylideneamino)-4-methyl-1,3-thiazol-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 5
References: 0
Patents: 209.09866 Da
Monoisotopic Mass: 2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	210.105936	144.7
[M+Na]+	232.087878	150.6
[M-H]-	208.091384	151.0
[M+NH4]+	227.132483	164.5
[M+K]+	248.061818	147.7
[M+H-H2O]+	192.095920	137.0
[M+HCOO]-	254.096861	164.2
[M+CH3COO]-	268.112511	189.2
[M+Na-2H]-	230.073326	147.0
[M]+	209.09811142	141.9
[M]-	209.09920858	141.9

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.