CID 3803233
5-cyclohexyl-1,3,4-oxadiazole-2-thiol
Structural Information
- Molecular Formula
- C8H12N2OS
- SMILES
- C1CCC(CC1)C2=NNC(=S)O2
- InChI
- InChI=1S/C8H12N2OS/c12-8-10-9-7(11-8)6-4-2-1-3-5-6/h6H,1-5H2,(H,10,12)
- InChIKey
- ONBUSMDUKULCRC-UHFFFAOYSA-N
- Compound name
- 5-cyclohexyl-3H-1,3,4-oxadiazole-2-thione
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 185.07431 | 138.4 |
[M+Na]+ | 207.05625 | 149.6 |
[M+NH4]+ | 202.10085 | 146.9 |
[M+K]+ | 223.03019 | 143.7 |
[M-H]- | 183.05975 | 141.8 |
[M+Na-2H]- | 205.04170 | 143.2 |
[M]+ | 184.06648 | 141.2 |
[M]- | 184.06758 | 141.2 |