SpectraBase Compound ID | IKYl56pTHhM |
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InChI | InChI=1S/C17H24O3/c1-3-5-6-14(4-2)13-20-17(19)12-9-15-7-10-16(18)11-8-15/h7-12,14,18H,3-6,13H2,1-2H3/b12-9- |
InChIKey | DAFFYDOASOLDQY-XFXZXTDPSA-N |
Mol Weight | 276.38 g/mol |
Molecular Formula | C17H24O3 |
Exact Mass | 276.172545 g/mol |
SpectraBase Spectrum ID | CJjVl21Opxv |
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Name | 3-(4-Hydroxyphenyl)propenoic acid 2-ethylhexyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 276.172544630 u |
Formula | C17H24O3 |
InChI | InChI=1S/C17H24O3/c1-3-5-6-14(4-2)13-20-17(19)12-9-15-7-10-16(18)11-8-15/h7-12,14,18H,3-6,13H2,1-2H3/b12-9- |
InChIKey | DAFFYDOASOLDQY-XFXZXTDPSA-N |
SMILES | C1(=CC=C(C=C1)\C=C/C(OCC(CCCC)CC)=O)O |