| SpectraBase Compound ID | ALs0nRkEiRD |
|---|---|
| InChI | InChI=1S/C12H13BrO/c13-12-9-5-4-8-11(12)7-3-1-2-6-10-14/h4-5,8-9,14H,1-2,6,10H2 |
| InChIKey | GAQMHFFDSIMKAP-UHFFFAOYSA-N |
| Mol Weight | 253.14 g/mol |
| Molecular Formula | C12H13BrO |
| Exact Mass | 252.014978 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JMkmxgbwty9 |
|---|---|
| Name | 6-(2-Bromophenyl)hex-5-yn-1-ol |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H13BrO |
| InChI | InChI=1S/C12H13BrO/c13-12-9-5-4-8-11(12)7-3-1-2-6-10-14/h4-5,8-9,14H,1-2,6,10H2 |
| InChIKey | GAQMHFFDSIMKAP-UHFFFAOYSA-N |
| Molecular Weight | 253.139 g/mol |
| SMILES | OCCCCC#Cc1c(Br)cccc1 |
| SPLASH | splash10-004i-0900000000-f0b5e1d362c94a733033 |
| Source of Spectrum | J-58-3021-2 |
| Wiley ID | 1255192 |