![(1S,6R,8S)-3,4-Cyclopentyl-8-(3'-iodopropyl)-8-chlorobicyclo[4.2.0]oct-3-en-7-one](/api/spectrum/AgvHCXdpbrU/structure.png?h=300&w=458 "(1S,6R,8S)-3,4-Cyclopentyl-8-(3'-iodopropyl)-8-chlorobicyclo[4.2.0]oct-3-en-7-one")
| SpectraBase Compound ID | 8AsQgO0Rvw7 |
|---|---|
| InChI | InChI=1S/C14H18ClIO/c15-14(5-2-6-16)12-8-10-4-1-3-9(10)7-11(12)13(14)17/h11-12H,1-8H2/t11-,12+,14+/m1/s1 |
| InChIKey | TWOVXUSRNYLAMM-DYEKYZERSA-N |
| Mol Weight | 364.65 g/mol |
| Molecular Formula | C14H18ClIO |
| Exact Mass | 364.009088 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AgvHCXdpbrU |
|---|---|
| Name | (1S,6R,8S)-3,4-Cyclopentyl-8-(3'-iodopropyl)-8-chlorobicyclo[4.2.0]oct-3-en-7-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H18ClIO |
| InChI | InChI=1S/C14H18ClIO/c15-14(5-2-6-16)12-8-10-4-1-3-9(10)7-11(12)13(14)17/h11-12H,1-8H2/t11-,12+,14+/m1/s1 |
| InChIKey | TWOVXUSRNYLAMM-DYEKYZERSA-N |
| Molecular Weight | 364.654 g/mol |
| SMILES | [C@@]12([C@](CC3=C(C2)CCC3)([H])C([C@]1(Cl)CCCI)=O)[H] |
| SPLASH | splash10-00dr-0946000000-bff4c3f241f1a58a5321 |
| Source of Spectrum | F-50-12587-27 |
| Synonyms | (1SR,6RS,8SR)-3,4-Cyclopentyl-8-(3'-iodopropyl)-8-chlorobicyclo[4.2.0]oct-3-en-7-one (2S,2aS,7aR)-2-Chloro-2-(3-iodo-propyl)-2,2a,3,4,5,6,7,7a-octahydro-cyclobuta[f]inden-1-one (2S,2aS,7aR)-2-chloro-2-(3-iodopropyl)-2,2a,3,4,5,6,7,7a-octahydro-1H-cyclobuta[f]inden-1-one |
| Wiley ID | 790046 |