SpectraBase Compound ID | Le7w2zp3NQJ |
---|---|
InChI | InChI=1S/C10H12O3/c1-2-13-10(12)9(11)8-6-4-3-5-7-8/h3-7,9,11H,2H2,1H3 |
InChIKey | SAXHIDRUJXPDOD-UHFFFAOYSA-N |
Mol Weight | 180.2 g/mol |
Molecular Formula | C10H12O3 |
Exact Mass | 180.078644 g/mol |
SpectraBase Spectrum ID | 2pqOLkogNbR |
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Name | Ethyl mandelate |
Comments | MONAID: JP010752 |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C10H12O3 |
InChI | InChI=1S/C10H12O3/c1-2-13-10(12)9(11)8-6-4-3-5-7-8/h3-7,9,11H,2H2,1H3 |
InChIKey | SAXHIDRUJXPDOD-UHFFFAOYSA-N |
Ionization Type | EI-B |
Molecular Weight | 180.203 g/mol |
SMILES | OC(C(OCC)=O)c1ccccc1 |
SPLASH | splash10-0a6r-8900000000-f2dffbee6dc92bb58462 |
Source of Spectrum | SRH-2022-10752-0 |
Wiley ID | 1832364 |