SpectraBase Compound ID | 53BzQ8c5MVM |
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InChI | InChI=1S/C20H30O4/c1-3-4-5-6-7-10-15-23-19(21)13-14-20(22)24-16-18-12-9-8-11-17(18)2/h8-9,11-12H,3-7,10,13-16H2,1-2H3 |
InChIKey | PZTNDTRXEISJTM-UHFFFAOYSA-N |
Mol Weight | 334.46 g/mol |
Molecular Formula | C20H30O4 |
Exact Mass | 334.214409 g/mol |
SpectraBase Spectrum ID | 4pCgGSDZaQP |
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Name | Succinic acid, 2-methylbenzyl octyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 334.214409442 u |
Formula | C20H30O4 |
InChI | InChI=1S/C20H30O4/c1-3-4-5-6-7-10-15-23-19(21)13-14-20(22)24-16-18-12-9-8-11-17(18)2/h8-9,11-12H,3-7,10,13-16H2,1-2H3 |
InChIKey | PZTNDTRXEISJTM-UHFFFAOYSA-N |
Molecular Weight | 334.456 g/mol |
SMILES | C(CCC(OCC=1C(C)=CC=CC1)=O)(OCCCCCCCC)=O |