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

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.074646 141.5
[M+Na]+ 228.056588 151.7
[M-H]- 204.060094 148.4
[M+NH4]+ 223.101193 163.9
[M+K]+ 244.030528 149.4
[M+H-H2O]+ 188.064630 134.5
[M+HCOO]- 250.065571 165.6
[M+CH3COO]- 264.081221 193.2
[M+Na-2H]- 226.042036 147.7
[M]+ 205.06682142 147.1
[M]- 205.06791858 147.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.