CID 46784924
1-{4h,5h,6h-cyclopenta[d][1,3]thiazol-2-yl}ethan-1-one
Structural Information
- Molecular Formula
- C8H9NOS
- SMILES
- CC(=O)C1=NC2=C(S1)CCC2
- InChI
- InChI=1S/C8H9NOS/c1-5(10)8-9-6-3-2-4-7(6)11-8/h2-4H2,1H3
- InChIKey
- LDLALUDRYCZSDR-UHFFFAOYSA-N
- Compound name
- 1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethanone
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 168.04776 | 135.5 |
[M+Na]+ | 190.02970 | 145.3 |
[M-H]- | 166.03320 | 139.6 |
[M+NH4]+ | 185.07430 | 160.3 |
[M+K]+ | 206.00364 | 143.7 |
[M+H-H2O]+ | 150.03774 | 130.8 |
[M+HCOO]- | 212.03868 | 153.5 |
[M+CH3COO]- | 226.05433 | 176.1 |
[M+Na-2H]- | 188.01515 | 136.2 |
[M]+ | 167.03993 | 137.8 |
[M]- | 167.04103 | 137.8 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.