| SpectraBase Spectrum ID |
2ZhgLlGzoW |
| Name |
Methyl 4-(trans-4-ethynylcyclohexyl)benzoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H18O2 |
| InChI |
InChI=1S/C16H18O2/c1-3-12-4-6-13(7-5-12)14-8-10-15(11-9-14)16(17)18-2/h1,8-13H,4-7H2,2H3/t12-,13- |
| InChIKey |
DJGVVNLFLQIYPC-JOCQHMNTSA-N |
| Literature Reference DOI |
10.1021/ol403673e |
| Molecular Weight |
242.318 g/mol |
| SMILES |
C1C[C@](CC[C@@]1(C#C)[H])(c1ccc(cc1)C(OC)=O)[H] |
| SPLASH |
splash10-01t9-3930000000-a91587fa23fb6c641b49 |
| Source of Spectrum |
A1-16-924/SM50-3ia |
| Synonyms |
Methyl 4-((1r,4r)-4-ethynylcyclohexyl)benzoate |
| Wiley ID |
1747730 |
