![(1R,6S)-7-oxabicyclo[4.1.0]heptane-5-carbonitrile](/api/spectrum/DbHaHRk8m9d/structure.png?h=300&w=458 "(1R,6S)-7-oxabicyclo[4.1.0]heptane-5-carbonitrile")
| SpectraBase Compound ID | 4D6WsuLCrRd |
|---|---|
| InChI | InChI=1S/C7H9NO/c8-4-5-2-1-3-6-7(5)9-6/h5-7H,1-3H2/t5?,6-,7+/m1/s1 |
| InChIKey | KEXPBJJFCKWMHW-FWPZAIACSA-N |
| Mol Weight | 123.15 g/mol |
| Molecular Formula | C7H9NO |
| Exact Mass | 123.068414 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DbHaHRk8m9d |
|---|---|
| Name | (1R,6S)-7-oxabicyclo[4.1.0]heptane-5-carbonitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H9NO |
| InChI | InChI=1S/C7H9NO/c8-4-5-2-1-3-6-7(5)9-6/h5-7H,1-3H2/t5?,6-,7+/m1/s1 |
| InChIKey | KEXPBJJFCKWMHW-FWPZAIACSA-N |
| Molecular Weight | 123.155 g/mol |
| SMILES | [C@]12(O[C@@]1(CCCC2C#N)[H])[H] |
| SPLASH | splash10-0gbc-9000000000-d4ed89da0476dc100e6c |
| Source of Spectrum | J-61-1840-5 |
| Wiley ID | 1128444 |