CID 170162
39123-31-4
Structural Information
- Molecular Formula
- C6H9NOS2
- SMILES
- CCCN1C(=O)CSC1=S
- InChI
- InChI=1S/C6H9NOS2/c1-2-3-7-5(8)4-10-6(7)9/h2-4H2,1H3
- InChIKey
- KKDLWQFJOGDMBI-UHFFFAOYSA-N
- Compound name
- 3-propyl-2-sulfanylidene-1,3-thiazolidin-4-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 176.01984 | 134.0 |
[M+Na]+ | 198.00178 | 143.4 |
[M-H]- | 174.00528 | 136.5 |
[M+NH4]+ | 193.04638 | 155.8 |
[M+K]+ | 213.97572 | 140.1 |
[M+H-H2O]+ | 158.00982 | 129.0 |
[M+HCOO]- | 220.01076 | 145.6 |
[M+CH3COO]- | 234.02641 | 177.2 |
[M+Na-2H]- | 195.98723 | 132.0 |
[M]+ | 175.01201 | 135.2 |
[M]- | 175.01311 | 135.2 |
Literature stripe
No literature data available for this compound.