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(empty object) |
SpectraBase Compound ID | FSSEOaG6F0J |
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InChI | InChI=1S/C9H9NO4S/c1-2-13-9(15)14-8-5-3-7(4-6-8)10(11)12/h3-6H,2H2,1H3 |
InChIKey | BYDJGZKLDZPEAU-UHFFFAOYSA-N |
Mol Weight | 227.23 g/mol |
Molecular Formula | C9H9NO4S |
Exact Mass | 227.025229 g/mol |
SpectraBase Spectrum ID | F4PH9g2PluL |
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Name | Ethoxy-(4-nitrophenoxy)methanethione |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 227.025228944 u |
Formula | C9H9NO4S |
InChI | InChI=1S/C9H9NO4S/c1-2-13-9(15)14-8-5-3-7(4-6-8)10(11)12/h3-6H,2H2,1H3 |
InChIKey | BYDJGZKLDZPEAU-UHFFFAOYSA-N |
Molecular Weight | 227.234 g/mol |
SMILES | C=1(N(=O)=O)C=CC(OC(=S)OCC)=CC1 |