CID 13912412
5-(chloromethyl)-n-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide
Structural Information
- Molecular Formula
- C11H10ClN3O2S
- SMILES
- COC1=CC=C(C=C1)NC(=O)C2=NN=C(S2)CCl
- InChI
- InChI=1S/C11H10ClN3O2S/c1-17-8-4-2-7(3-5-8)13-10(16)11-15-14-9(6-12)18-11/h2-5H,6H2,1H3,(H,13,16)
- InChIKey
- RPCZBDYLOGCODX-UHFFFAOYSA-N
- Compound name
- 5-(chloromethyl)-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 284.02550 | 159.3 |
[M+Na]+ | 306.00744 | 169.1 |
[M-H]- | 282.01094 | 164.3 |
[M+NH4]+ | 301.05204 | 175.6 |
[M+K]+ | 321.98138 | 164.3 |
[M+H-H2O]+ | 266.01548 | 152.0 |
[M+HCOO]- | 328.01642 | 173.8 |
[M+CH3COO]- | 342.03207 | 196.2 |
[M+Na-2H]- | 303.99289 | 160.9 |
[M]+ | 283.01767 | 164.8 |
[M]- | 283.01877 | 164.8 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.