CID 14763520

5-chloro-n,n-dimethyl-1,2,4-thiadiazol-3-amine

Structural Information

Molecular Formula

C₄H₆ClN₃S

SMILES

CN(C)C1=NSC(=N1)Cl

InChI

InChI=1S/C4H6ClN3S/c1-8(2)4-6-3(5)9-7-4/h1-2H3

InChIKey

CUTXHPVVEVMARX-UHFFFAOYSA-N

Compound name

5-chloro-N,N-dimethyl-1,2,4-thiadiazol-3-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 11
Patents: 162.9971 Da
Monoisotopic Mass: 2.2
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]+	164.00438	130.0
[M+Na]+	185.98632	141.9
[M+NH4]+	181.03092	139.2
[M+K]+	201.96026	135.8
[M-H]-	161.98982	131.7
[M+Na-2H]-	183.97177	135.8
[M]+	162.99655	132.8
[M]-	162.99765	132.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe