CID 13295037
S-isobutyl chlorothioformate
Structural Information
- Molecular Formula
- C5H9ClOS
- SMILES
- CC(C)CSC(=O)Cl
- InChI
- InChI=1S/C5H9ClOS/c1-4(2)3-8-5(6)7/h4H,3H2,1-2H3
- InChIKey
- COAWFKOHQQDMBK-UHFFFAOYSA-N
- Compound name
- S-(2-methylpropyl) chloromethanethioate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 153.01355 | 127.2 |
[M+Na]+ | 174.99549 | 135.4 |
[M-H]- | 150.99899 | 128.2 |
[M+NH4]+ | 170.04009 | 149.9 |
[M+K]+ | 190.96943 | 133.2 |
[M+H-H2O]+ | 135.00353 | 124.0 |
[M+HCOO]- | 197.00447 | 139.8 |
[M+CH3COO]- | 211.02012 | 174.1 |
[M+Na-2H]- | 172.98094 | 128.6 |
[M]+ | 152.00572 | 131.3 |
[M]- | 152.00682 | 131.3 |
Literature stripe
No literature data available for this compound.