CID 9632821

853356-13-5

Structural Information

Molecular Formula

C₁₀H₁₁N₃S

SMILES

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

InChI

InChI=1S/C10H11N3S/c1-13(2)7-11-10-12-8-5-3-4-6-9(8)14-10/h3-7H,1-2H3/b11-7+

InChIKey

DCWDATDHZDWTPZ-YRNVUSSQSA-N

Compound name

N'-(1,3-benzothiazol-2-yl)-N,N-dimethylmethanimidamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 0
Patents: 205.06737 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]+	206.07465	142.3
[M+Na]+	228.05659	154.7
[M+NH4]+	223.10119	152.2
[M+K]+	244.03053	147.2
[M-H]-	204.06009	146.5
[M+Na-2H]-	226.04204	149.9
[M]+	205.06682	145.7
[M]-	205.06792	145.7

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.