| SpectraBase Spectrum ID |
8JQbFi8suR6 |
| Name |
Di-2-Propenyl-trisulfide |
| CAS Registry Number |
2050-87-5 |
| Classification |
Ingredient of garlic oil |
| Comments |
Spectrum verified by crosschecking against external libraries (two reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
177.994463844 u |
| Formula |
C6H10S3 |
| InChI |
InChI=1S/C6H10S3/c1-3-5-7-9-8-6-4-2/h3-4H,1-2,5-6H2 |
| InChIKey |
UBAXRAHSPKWNCX-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
178.326 g/mol |
| Nominal Mass |
178 u |
| Quality |
986 |
| Retention Index |
1100 |
| SMILES |
C(SSSCC=C)C=C |
| SPLASH |
splash10-022d-9200000000-3520026e6cd3b5207e3f |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1,3-di(prop-2-en-1-yl)trisulfane |
| Technique |
GC/MS |
| Wiley ID |
DD2024_006928 |
