| SpectraBase Compound ID | MIYloeV0yO |
|---|---|
| InChI | InChI=1S/C11H16O2S3/c1-12-7-6-8(14-3)9(13-2)11(16-5)10(7)15-4/h6H,1-5H3 |
| InChIKey | DDYPUVVDCCATCI-UHFFFAOYSA-N |
| Mol Weight | 276.43 g/mol |
| Molecular Formula | C11H16O2S3 |
| Exact Mass | 276.031243 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 7rrWc6Qr8GO |
|---|---|
| Name | 2,3,5-(Triglutathion-S-yl)-hydroquinone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 276.031243275 u |
| Formula | C11H16O2S3 |
| InChI | InChI=1S/C11H16O2S3/c1-12-7-6-8(14-3)9(13-2)11(16-5)10(7)15-4/h6H,1-5H3 |
| InChIKey | DDYPUVVDCCATCI-UHFFFAOYSA-N |
| Molecular Weight | 276.427 g/mol |
| SMILES | C=1(C(=C(OC)C=C(C1OC)SC)SC)SC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.936126 |