CID 6427118
Furan, 3-(ethyldithio)-2-methyl-
Structural Information
- Molecular Formula
- C7H10OS2
- SMILES
- CCSSC1=C(OC=C1)C
- InChI
- InChI=1S/C7H10OS2/c1-3-9-10-7-4-5-8-6(7)2/h4-5H,3H2,1-2H3
- InChIKey
- ZPINLCXQMSVOQT-UHFFFAOYSA-N
- Compound name
- 3-(ethyldisulfanyl)-2-methylfuran
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 175.02458 | 132.4 |
[M+Na]+ | 197.00652 | 142.4 |
[M-H]- | 173.01002 | 137.4 |
[M+NH4]+ | 192.05112 | 154.5 |
[M+K]+ | 212.98046 | 140.5 |
[M+H-H2O]+ | 157.01456 | 127.9 |
[M+HCOO]- | 219.01550 | 146.9 |
[M+CH3COO]- | 233.03115 | 177.4 |
[M+Na-2H]- | 194.99197 | 133.5 |
[M]+ | 174.01675 | 137.7 |
[M]- | 174.01785 | 137.7 |