| SpectraBase Compound ID | 5iouUuOO5P2 |
|---|---|
| InChI | InChI=1S/C15H19ClO/c1-3-5-6-12-15-14(16)11-8-7-10-13(17-15)9-4-2/h1,4-9,13-15H,10-12H2,2H3/b6-5-,8-7-,9-4+/t13-,14+,15+/m1/s1 |
| InChIKey | RYCMNZMJYZRUAM-SNFZDAOBSA-N |
| Mol Weight | 250.77 g/mol |
| Molecular Formula | C15H19ClO |
| Exact Mass | 250.112443 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FIXPXpyCLdz |
|---|---|
| Name | (3Z)-laurenyne |
| Alternate Name(s) | (2S,3S,5Z,8S)-3-chloranyl-2-[(Z)-pent-2-en-4-ynyl]-8-[(E)-prop-1-enyl]-3,4,7,8-tetrahydro-2H-oxocine (2S,3S,5Z,8S)-3-chloro-2-[(Z)-pent-2-en-4-ynyl]-8-[(E)-prop-1-enyl]-3,4,7,8-tetrahydro-2H-oxocin (2S,3S,5Z,8S)-3-chloro-2-[(Z)-pent-2-en-4-ynyl]-8-[(E)-prop-1-enyl]-3,4,7,8-tetrahydro-2H-oxocine |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H19ClO |
| InChI | InChI=1S/C15H19ClO/c1-3-5-6-12-15-14(16)11-8-7-10-13(17-15)9-4-2/h1,4-9,13-15H,10-12H2,2H3/b6-5-,8-7-,9-4+/t13-,14+,15+/m1/s1 |
| InChIKey | RYCMNZMJYZRUAM-SNFZDAOBSA-N |
| Molecular Weight | 250.769 g/mol |
| SMILES | [C@@]1(O[C@@](C\C=C/C[C@@]1(Cl)[H])(\C=C\C)[H])(C\C=C/C#C)[H] |
| SPLASH | splash10-00ko-9430000000-65ef7e219db76b76cb66 |
| Source of Spectrum | G4-65-398-2 |
| Wiley ID | 1639319 |