SpectraBase Compound ID | 2LlsAcTsDsa |
---|---|
InChI | InChI=1S/C11H13NO/c1-9(13)3-4-10-5-7-11(12-2)8-6-10/h3-8,12H,1-2H3/b4-3+ |
InChIKey | XXILVBNIVUOKAT-ONEGZZNKSA-N |
Mol Weight | 175.23 g/mol |
Molecular Formula | C11H13NO |
Exact Mass | 175.099714 g/mol |
SpectraBase Spectrum ID | AVUecBvDvSc |
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Name | Poly(vinylene-1,4-phenylene amide) |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 175.099714042 u |
Formula | C11H13NO |
InChI | InChI=1S/C11H13NO/c1-9(13)3-4-10-5-7-11(12-2)8-6-10/h3-8,12H,1-2H3/b4-3+ |
InChIKey | XXILVBNIVUOKAT-ONEGZZNKSA-N |
Molecular Weight | 175.231 g/mol |
Nominal Mass | 175 u |
SMILES | N(C=1C=CC(=CC1)\C=C\C(=O)C)C |
Spectrum/Structure Validation Score (Raman) | 0.813185 |