| SpectraBase Compound ID | J0mDcyY3zHv |
|---|---|
| InChI | InChI=1S/C13H21NO2S2/c1-3-4-9-7-11(16-13(17)18-2)8-10-5-6-12(15)14(9)10/h9-11H,3-8H2,1-2H3 |
| InChIKey | ZQHBKQRCDSJTCO-UHFFFAOYSA-N |
| Mol Weight | 287.44 g/mol |
| Molecular Formula | C13H21NO2S2 |
| Exact Mass | 287.101371 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EZn6L7fFOO4 |
|---|---|
| Name | (methylthio)methanethioic acid O-(3-keto-5-propyl-indolizidin-7-yl) ester |
| Alternate Name(s) | (methylthio)methanethioic acid O-(3-oxo-5-propyl-2,5,6,7,8,8a-hexahydro-1H-indolizin-7-yl) ester O-(3-oxidanylidene-5-propyl-2,5,6,7,8,8a-hexahydro-1H-indolizin-7-yl) methylsulfanylmethanethioate O-(3-oxo-5-propyl-2,5,6,7,8,8a-hexahydro-1H-indolizin-7-yl) methylsulfanylmethanethioate |
| CAS Registry Number | 82979-14-4 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H21NO2S2 |
| InChI | InChI=1S/C13H21NO2S2/c1-3-4-9-7-11(16-13(17)18-2)8-10-5-6-12(15)14(9)10/h9-11H,3-8H2,1-2H3 |
| InChIKey | ZQHBKQRCDSJTCO-UHFFFAOYSA-N |
| Molecular Weight | 287.436 g/mol |
| SMILES | CCCC1N2C(CC(C1)OC(SC)=S)CCC2=O |
| SPLASH | splash10-001i-3900000000-8a6b19591f94e91d499e |
| Source of Spectrum | J-47-4406-0 |
| Wiley ID | 1290660 |