| SpectraBase Compound ID | 4BVOCyOVFt |
|---|---|
| InChI | InChI=1S/C7H12O/c1-2-3-4-5-6-7-8/h2-3,7H,4-6H2,1H3/b3-2+ |
| InChIKey | UDOAKURRCZMWOJ-NSCUHMNNSA-N |
| Mol Weight | 112.17 g/mol |
| Molecular Formula | C7H12O |
| Exact Mass | 112.088815 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JzRPywyckQq |
|---|---|
| Name | (E)-5-heptenal |
| Alternate Name(s) | (E)-hept-5-enal |
| CAS Registry Number | 21662-19-1 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H12O |
| InChI | InChI=1S/C7H12O/c1-2-3-4-5-6-7-8/h2-3,7H,4-6H2,1H3/b3-2+ |
| InChIKey | UDOAKURRCZMWOJ-NSCUHMNNSA-N |
| Molecular Weight | 112.172 g/mol |
| SMILES | C(\C=C\C)CCC=O |
| SPLASH | splash10-0006-9000000000-5d291353c04e5adb7a18 |
| Source of Spectrum | F-41-3505-47 |
| Wiley ID | 1123471 |