| SpectraBase Compound ID | 72VpQqTB0Ma |
|---|---|
| InChI | InChI=1S/C11H17NO/c12-8-7-10-6-5-9-3-1-2-4-11(9)13-10/h9-11H,1-7H2 |
| InChIKey | UWIABZNGMSJGGG-UHFFFAOYSA-N |
| Mol Weight | 179.26 g/mol |
| Molecular Formula | C11H17NO |
| Exact Mass | 179.131014 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4S59FiL3p9s |
|---|---|
| Name | Octahydro-2H-chromen-2-ylacetonitrile |
| CAS Registry Number | 83041-46-7 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H17NO |
| InChI | InChI=1S/C11H17NO/c12-8-7-10-6-5-9-3-1-2-4-11(9)13-10/h9-11H,1-7H2 |
| InChIKey | UWIABZNGMSJGGG-UHFFFAOYSA-N |
| Molecular Weight | 179.263 g/mol |
| SMILES | C1CC2C(CC1)CCC(O2)CC#N |
| SPLASH | splash10-00y9-6900000000-b15fa12d08723289f18c |
| Source of Spectrum | H-65-448-0 |
| Synonyms | 2-(3,4,4a,5,6,7,8,8a-octahydro-2H-1-benzopyran-2-yl)acetonitrile 2-(3,4,4a,5,6,7,8,8a-octahydro-2H-chromen-2-yl)acetonitrile 2-(3,4,4a,5,6,7,8,8a-octahydro-2H-chromen-2-yl)ethanenitrile |
| Wiley ID | 1175393 |