CID 31072
Carbimazole
Structural Information
- Molecular Formula
- C7H10N2O2S
- SMILES
- CCOC(=O)N1C=CN(C1=S)C
- InChI
- InChI=1S/C7H10N2O2S/c1-3-11-7(10)9-5-4-8(2)6(9)12/h4-5H,3H2,1-2H3
- InChIKey
- CFOYWRHIYXMDOT-UHFFFAOYSA-N
- Compound name
- ethyl 3-methyl-2-sulfanylideneimidazole-1-carboxylate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 187.05358 | 137.2 |
[M+Na]+ | 209.03552 | 148.0 |
[M-H]- | 185.03902 | 139.4 |
[M+NH4]+ | 204.08012 | 157.4 |
[M+K]+ | 225.00946 | 146.1 |
[M+H-H2O]+ | 169.04356 | 131.1 |
[M+HCOO]- | 231.04450 | 155.2 |
[M+CH3COO]- | 245.06015 | 178.7 |
[M+Na-2H]- | 207.02097 | 137.9 |
[M]+ | 186.04575 | 141.9 |
[M]- | 186.04685 | 141.9 |