| SpectraBase Compound ID | 2sIse0MQFSD |
|---|---|
| InChI | InChI=1S/C15H16/c1-2-5-9-14(8-4-1)12-13-15-10-6-3-7-11-15/h3,6-8,10-11H,1-2,4-5,9H2 |
| InChIKey | CLJHDRVOELZERH-UHFFFAOYSA-N |
| Mol Weight | 196.29 g/mol |
| Molecular Formula | C15H16 |
| Exact Mass | 196.125201 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | ngZQ3lu4h |
|---|---|
| Name | 1-(2-Phenylethynyl)cycloheptene |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H16 |
| InChI | InChI=1S/C15H16/c1-2-5-9-14(8-4-1)12-13-15-10-6-3-7-11-15/h3,6-8,10-11H,1-2,4-5,9H2 |
| InChIKey | CLJHDRVOELZERH-UHFFFAOYSA-N |
| Molecular Weight | 196.293 g/mol |
| SMILES | C(#Cc1ccccc1)C1=CCCCCC1 |
| SPLASH | splash10-00kb-0900000000-a78ff088af2996e50b2e |
| Source of Spectrum | J-63-9012-21 |
| Wiley ID | 1194173 |