| SpectraBase Compound ID | 4F8XNhNSEFF |
|---|---|
| InChI | InChI=1S/C9H12O2/c1-4-5-8(2)6-7-9(10)11-3/h4-5,7H,1-3H3/b5-4+ |
| InChIKey | AVRGUHBPPAOVSB-SNAWJCMRSA-N |
| Mol Weight | 152.19 g/mol |
| Molecular Formula | C9H12O2 |
| Exact Mass | 152.08373 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IvX3JiVARA1 |
|---|---|
| Name | (E)-methyl 4-methylhepta-2,3,5-trienoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H12O2 |
| InChI | InChI=1S/C9H12O2/c1-4-5-8(2)6-7-9(10)11-3/h4-5,7H,1-3H3/b5-4+ |
| InChIKey | AVRGUHBPPAOVSB-SNAWJCMRSA-N |
| Literature Reference DOI | 10.1021/jo5014993 |
| Molecular Weight | 152.193 g/mol |
| SMILES | C\C=C\C(C)=C=CC(OC)=O |
| SPLASH | splash10-054o-9200000000-0de6a67a6b5907b70027 |
| Source of Spectrum | J-79-9229-(E)_2pa |
| Wiley ID | 1748152 |