| SpectraBase Compound ID | CIUPHDuFVPU |
|---|---|
| InChI | InChI=1S/C9H17N/c1-3-4-5-6-7-9(2)8-10/h9H,3-7H2,1-2H3 |
| InChIKey | KOVZMYUXIJOHCD-UHFFFAOYSA-N |
| Mol Weight | 139.24 g/mol |
| Molecular Formula | C9H17N |
| Exact Mass | 139.1361 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BQTCZO0O4dQ |
|---|---|
| Name | 2-Methyloctanenitrile |
| Alternate Name(s) | 2-Methylcaprylonitrile EINECS 219-914-8 |
| CAS Registry Number | 2570-96-9 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H17N |
| InChI | InChI=1S/C9H17N/c1-3-4-5-6-7-9(2)8-10/h9H,3-7H2,1-2H3 |
| InChIKey | KOVZMYUXIJOHCD-UHFFFAOYSA-N |
| Molecular Weight | 139.242 g/mol |
| SMILES | C(#N)C(CCCCCC)C |
| SPLASH | splash10-0005-9100000000-048ead0686ab941e5806 |
| Source of Spectrum | J-55-1074-7 |
| Wiley ID | 201070 |