| SpectraBase Spectrum ID |
2mD1JV3qgMK |
| Name |
1-Allyl-2-isopropyldisulfane |
| CAS Registry Number |
67421-85-6 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
148.038042734 u |
| Formula |
C6H12S2 |
| InChI |
InChI=1S/C6H12S2/c1-4-5-7-8-6(2)3/h4,6H,1,5H2,2-3H3 |
| InChIKey |
BQMYJJMTHCLMRB-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
148.282 g/mol |
| Nominal Mass |
148 u |
| Quality |
970 |
| Retention Index |
932 |
| SMILES |
C(SSCC=C)(C)C |
| SPLASH |
splash10-052g-9600000000-b8415046dfca832d9371 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
3-(Isopropyldisulfanyl)-1-propene |
| Technique |
GC/MS |
| Wiley ID |
DD2024_019258 |
