![2-[(3-Methoxyphenyl)sulfanyl]acetic acid, tert-butyldimethylsilyl ester](/api/spectrum/FXVe1ohamvu/structure.png?h=300&w=458 "2-[(3-Methoxyphenyl)sulfanyl]acetic acid, tert-butyldimethylsilyl ester")
| SpectraBase Compound ID | KSbMVoBAJWZ |
|---|---|
| InChI | InChI=1S/C15H24O3SSi/c1-15(2,3)20(5,6)18-14(16)11-19-13-9-7-8-12(10-13)17-4/h7-10H,11H2,1-6H3 |
| InChIKey | VZOUGQQZTPGOCH-UHFFFAOYSA-N |
| Mol Weight | 312.5 g/mol |
| Molecular Formula | C15H24O3SSi |
| Exact Mass | 312.121542 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FXVe1ohamvu |
|---|---|
| Name | 2-[(3-Methoxyphenyl)sulfanyl]acetic acid, tert-butyldimethylsilyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 312.121542339 u |
| Formula | C15H24O3SSi |
| InChI | InChI=1S/C15H24O3SSi/c1-15(2,3)20(5,6)18-14(16)11-19-13-9-7-8-12(10-13)17-4/h7-10H,11H2,1-6H3 |
| InChIKey | VZOUGQQZTPGOCH-UHFFFAOYSA-N |
| SMILES | C(SC1=CC(=CC=C1)OC)C(=O)O[Si](C)(C(C)(C)C)C |