| SpectraBase Compound ID | CDRcJHvl0wB |
|---|---|
| InChI | InChI=1S/C12H12O/c1-13-12-4-2-3-11(9-12)8-7-10-5-6-10/h2-4,9-10H,5-6H2,1H3 |
| InChIKey | NFATVQMGNFXWRE-UHFFFAOYSA-N |
| Mol Weight | 172.23 g/mol |
| Molecular Formula | C12H12O |
| Exact Mass | 172.088815 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GgA4lDqcQfe |
|---|---|
| Name | 1-(2-cyclopropylethynyl)-3-methoxy-benzene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H12O |
| InChI | InChI=1S/C12H12O/c1-13-12-4-2-3-11(9-12)8-7-10-5-6-10/h2-4,9-10H,5-6H2,1H3 |
| InChIKey | NFATVQMGNFXWRE-UHFFFAOYSA-N |
| Molecular Weight | 172.227 g/mol |
| SMILES | C(#Cc1cc(OC)ccc1)C1CC1 |
| SPLASH | splash10-00di-0900000000-331f89ce4df6b4f0ab16 |
| Source of Spectrum | U1-2002-1216-9 |
| Wiley ID | 1522379 |