| SpectraBase Compound ID | 64bUd5PgeFQ |
|---|---|
| InChI | InChI=1S/C14H16O/c1-10(2)9-12-8-7-11-5-3-4-6-13(11)14(12)15/h3-6,9-10H,7-8H2,1-2H3/b12-9+ |
| InChIKey | CXSDUFDSGWVJPN-FMIVXFBMSA-N |
| Mol Weight | 200.28 g/mol |
| Molecular Formula | C14H16O |
| Exact Mass | 200.120115 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HKeF0aaqcl2 |
|---|---|
| Name | (2E)-2-(2-Methylpropylidene)-3,4-dihydronaphthalen-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 200.120115134 u |
| Formula | C14H16O |
| InChI | InChI=1S/C14H16O/c1-10(2)9-12-8-7-11-5-3-4-6-13(11)14(12)15/h3-6,9-10H,7-8H2,1-2H3/b12-9+ |
| InChIKey | CXSDUFDSGWVJPN-FMIVXFBMSA-N |
| Molecular Weight | 200.281 g/mol |
| SMILES | C1(\C(CCC=2C=CC=CC12)=C\C(C)C)=O |