![2-propenoic acid, 3-[4-(phenylmethoxy)phenyl]-, (2E)-](/api/spectrum/DBFABN3MLSi/structure.png?h=300&w=458 "2-propenoic acid, 3-[4-(phenylmethoxy)phenyl]-, (2E)-")
| SpectraBase Compound ID | AIO9Ku8cc4p |
|---|---|
| InChI | InChI=1S/C16H14O3/c17-16(18)11-8-13-6-9-15(10-7-13)19-12-14-4-2-1-3-5-14/h1-11H,12H2,(H,17,18)/b11-8+ |
| InChIKey | HCMSDYVKYZIYGA-DHZHZOJOSA-N |
| Mol Weight | 254.28 g/mol |
| Molecular Formula | C16H14O3 |
| Exact Mass | 254.094294 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DBFABN3MLSi |
|---|---|
| Name | 2-Propenoic acid, 3-[4-(phenylmethoxy)phenyl]-, (2E)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 254.094294308 u |
| Formula | C16H14O3 |
| InChI | InChI=1S/C16H14O3/c17-16(18)11-8-13-6-9-15(10-7-13)19-12-14-4-2-1-3-5-14/h1-11H,12H2,(H,17,18)/b11-8+ |
| InChIKey | HCMSDYVKYZIYGA-DHZHZOJOSA-N |
| Molecular Weight | 254.285 g/mol |
| SMILES | OC(\C=C\C=1C=CC(OCC2=CC=CC=C2)=CC1)=O |