CID 288547
            
    Benzothiazole, 2,3-dihydro-2-(1h-pyrrol-2-yl)-
Structural Information
- Molecular Formula
 - C11H10N2S
 - SMILES
 - C1=CC=C2C(=C1)NC(S2)C3=CC=CN3
 - InChI
 - InChI=1S/C11H10N2S/c1-2-6-10-8(4-1)13-11(14-10)9-5-3-7-12-9/h1-7,11-13H
 - InChIKey
 - TWDUIGDCMXGSRY-UHFFFAOYSA-N
 - Compound name
 - 2-(1H-pyrrol-2-yl)-2,3-dihydro-1,3-benzothiazole
 - Related CIDs
 
2D Structure
Profile
Predicted Collision Cross Section
| Adduct | m/z | Predicted CCS (Ų) | 
|---|---|---|
| [M+H]+ | 203.06375 | 141.7 | 
| [M+Na]+ | 225.04569 | 151.3 | 
| [M-H]- | 201.04919 | 144.9 | 
| [M+NH4]+ | 220.09029 | 162.3 | 
| [M+K]+ | 241.01963 | 146.0 | 
| [M+H-H2O]+ | 185.05373 | 135.9 | 
| [M+HCOO]- | 247.05467 | 157.1 | 
| [M+CH3COO]- | 261.07032 | 154.3 | 
| [M+Na-2H]- | 223.03114 | 143.3 | 
| [M]+ | 202.05592 | 139.6 | 
| [M]- | 202.05702 | 139.6 | 
Literature stripe
Patent stripe
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