SpectraBase Compound ID | HNSWAAxfWvB |
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InChI | InChI=1S/C10H8O/c1-2-4-8-7(3-1)9-5-6-10(8)11-9/h1-6,9-10H/t9-,10+ |
InChIKey | JWCGDNHAPBZVHD-AOOOYVTPSA-N |
Mol Weight | 144.17 g/mol |
Molecular Formula | C10H8O |
Exact Mass | 144.057515 g/mol |
SpectraBase Spectrum ID | 70CSECdm6ce |
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Name | 9-oxa-Benzonorbornadiene |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 144.057514877 u |
Formula | C10H8O |
InChI | InChI=1S/C10H8O/c1-2-4-8-7(3-1)9-5-6-10(8)11-9/h1-6,9-10H/t9-,10+ |
InChIKey | JWCGDNHAPBZVHD-AOOOYVTPSA-N |
Molecular Weight | 144.173 g/mol |
SMILES | [C@]12(O[C@](C=C2)(C2=CC=CC=C12)[H])[H] |
Spectrum/Structure Validation Score (Raman) | 0.804395 |