CID 57238243
2,4-dimethylpentane-1-thiol
Structural Information
- Molecular Formula
- C7H16S
- SMILES
- CC(C)CC(C)CS
- InChI
- InChI=1S/C7H16S/c1-6(2)4-7(3)5-8/h6-8H,4-5H2,1-3H3
- InChIKey
- RVALCVRBKDPIDY-UHFFFAOYSA-N
- Compound name
- 2,4-dimethylpentane-1-thiol
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 133.10455 | 129.1 |
[M+Na]+ | 155.08649 | 135.4 |
[M-H]- | 131.08999 | 129.6 |
[M+NH4]+ | 150.13109 | 151.8 |
[M+K]+ | 171.06043 | 135.0 |
[M+H-H2O]+ | 115.09453 | 124.5 |
[M+HCOO]- | 177.09547 | 144.9 |
[M+CH3COO]- | 191.11112 | 176.0 |
[M+Na-2H]- | 153.07194 | 129.7 |
[M]+ | 132.09672 | 131.5 |
[M]- | 132.09782 | 131.5 |
Literature stripe
No literature data available for this compound.