CID 19995

N,n-dimethyl-2-benzothiazolamine

Structural Information

Molecular Formula

C₉H₁₀N₂S

SMILES

CN(C)C1=NC2=CC=CC=C2S1

InChI

InChI=1S/C9H10N2S/c1-11(2)9-10-7-5-3-4-6-8(7)12-9/h3-6H,1-2H3

InChIKey

RIHDPQKLSOXBOH-UHFFFAOYSA-N

Compound name

N,N-dimethyl-1,3-benzothiazol-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 56
Patents: 178.05647 Da
Monoisotopic Mass: 2.7
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]+	179.06375	134.4
[M+Na]+	201.04569	147.8
[M+NH4]+	196.09029	144.9
[M+K]+	217.01963	140.5
[M-H]-	177.04919	138.2
[M+Na-2H]-	199.03114	142.1
[M]+	178.05592	137.9
[M]-	178.05702	137.9

Literature stripe

literature stripe

Patent stripe

patents stripe