CID 522877
2-ethyl-4,5-dimethylthiazole
Structural Information
- Molecular Formula
- C7H11NS
- SMILES
- CCC1=NC(=C(S1)C)C
- InChI
- InChI=1S/C7H11NS/c1-4-7-8-5(2)6(3)9-7/h4H2,1-3H3
- InChIKey
- BVOKJOZBJOWZNJ-UHFFFAOYSA-N
- Compound name
- 2-ethyl-4,5-dimethyl-1,3-thiazole
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 142.06850 | 126.6 |
[M+Na]+ | 164.05044 | 137.3 |
[M-H]- | 140.05394 | 130.1 |
[M+NH4]+ | 159.09504 | 150.2 |
[M+K]+ | 180.02438 | 135.4 |
[M+H-H2O]+ | 124.05848 | 121.4 |
[M+HCOO]- | 186.05942 | 146.0 |
[M+CH3COO]- | 200.07507 | 174.3 |
[M+Na-2H]- | 162.03589 | 128.5 |
[M]+ | 141.06067 | 130.1 |
[M]- | 141.06177 | 130.1 |