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]+ 206.07465 141.5
[M+Na]+ 228.05659 151.7
[M-H]- 204.06009 148.4
[M+NH4]+ 223.10119 163.9
[M+K]+ 244.03053 149.4
[M+H-H2O]+ 188.06463 134.5
[M+HCOO]- 250.06557 165.6
[M+CH3COO]- 264.08122 193.2
[M+Na-2H]- 226.04204 147.7
[M]+ 205.06682 147.1
[M]- 205.06792 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.