SpectraBase Compound ID | EpeL70mmNO3 |
---|---|
InChI | InChI=1S/C9H10OS/c10-7-4-8-11-9-5-2-1-3-6-9/h1-3,5-7H,4,8H2 |
InChIKey | WPKQWNJKYYXGJZ-UHFFFAOYSA-N |
Mol Weight | 166.24 g/mol |
Molecular Formula | C9H10OS |
Exact Mass | 166.045236 g/mol |
SpectraBase Spectrum ID | 3zbp6973Ctt |
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Name | 3-(Phenylthio)propanal |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C9H10OS |
InChI | InChI=1S/C9H10OS/c10-7-4-8-11-9-5-2-1-3-6-9/h1-3,5-7H,4,8H2 |
InChIKey | WPKQWNJKYYXGJZ-UHFFFAOYSA-N |
Literature Reference DOI | 10.1002/cctc.201100465 |
Molecular Weight | 166.238 g/mol |
SMILES | C(CCSc1ccccc1)=O |
SPLASH | splash10-03di-2900000000-acb3a0f8c186fe6b3349 |
Source of Spectrum | CCC-4-329/SM4-4_2 |
Wiley ID | 1788902 |