![1-(5-Hexenyl)-6-methoxy-3-(methoxycarbonyl)bicyclo[3.3.0]octan-2-one](/api/spectrum/DA37Ql4smoC/structure.png?h=300&w=458 "1-(5-Hexenyl)-6-methoxy-3-(methoxycarbonyl)bicyclo[3.3.0]octan-2-one")
| SpectraBase Compound ID | 6uVQ6auJvmx |
|---|---|
| InChI | InChI=1S/C17H26O4/c1-4-5-6-7-9-17-10-8-14(20-2)13(17)11-12(15(17)18)16(19)21-3/h4,12-14H,1,5-11H2,2-3H3/t12?,13-,14-,17+/m1/s1 |
| InChIKey | OBQWSFSBEVIJRE-XMTFAYGESA-N |
| Mol Weight | 294.39 g/mol |
| Molecular Formula | C17H26O4 |
| Exact Mass | 294.183109 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DA37Ql4smoC |
|---|---|
| Name | 1-(5-Hexenyl)-6-methoxy-3-(methoxycarbonyl)bicyclo[3.3.0]octan-2-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H26O4 |
| InChI | InChI=1S/C17H26O4/c1-4-5-6-7-9-17-10-8-14(20-2)13(17)11-12(15(17)18)16(19)21-3/h4,12-14H,1,5-11H2,2-3H3/t12?,13-,14-,17+/m1/s1 |
| InChIKey | OBQWSFSBEVIJRE-XMTFAYGESA-N |
| Molecular Weight | 294.391 g/mol |
| SMILES | [C@@]12(C(C(C(=O)OC)C[C@@]2([C@](OC)(CC1)[H])[H])=O)CCCCC=C |
| SPLASH | splash10-001i-0960000000-9838b6e7dc1d92792d23 |
| Source of Spectrum | J-60-1386-28 |
| Synonyms | (3aS,4R,6aS)-6a-Hex-5-enyl-4-methoxy-1-oxo-octahydro-pentalene-2-carboxylic acid methyl ester Methyl 6a-(5-hexenyl)-4-methoxy-1-oxooctahydro-2-pentalenecarboxylate (3aS,6R,6aS)-3a-hex-5-enyl-6-methoxy-3-oxo-1,2,4,5,6,6a-hexahydropentalene-2-carboxylic acid methyl ester Methyl (3aS,6R,6aS)-3a-hex-5-enyl-6-methoxy-3-oxo-1,2,4,5,6,6a-hexahydropentalene-2-carboxylate Methyl (3aS,6R,6aS)-3a-hex-5-enyl-6-methoxy-3-oxidanylidene-1,2,4,5,6,6a-hexahydropentalene-2-carboxylate |
| Wiley ID | 1297309 |