| SpectraBase Compound ID | fv5B5pR03X |
|---|---|
| InChI | InChI=1S/C11H13NO3.ClH/c1-12-3-2-7-4-9-10(15-6-14-9)5-8(7)11(12)13;/h4-5,11,13H,2-3,6H2,1H3;1H |
| InChIKey | DLNQCQJCIITVHC-UHFFFAOYSA-N |
| Mol Weight | 243.69 g/mol |
| Molecular Formula | C11H14ClNO3 |
| Exact Mass | 243.066221 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | E4yyGOcfnae |
|---|---|
| Name | Hydrastinine HC l inkbr |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 243.066221012 u |
| Formula | C11H14ClNO3 |
| InChI | InChI=1S/C11H13NO3.ClH/c1-12-3-2-7-4-9-10(15-6-14-9)5-8(7)11(12)13;/h4-5,11,13H,2-3,6H2,1H3;1H |
| InChIKey | DLNQCQJCIITVHC-UHFFFAOYSA-N |
| Molecular Weight | 243.690 g/mol |
| SMILES | OC1N(CCC2=C1C=C1C(=C2)OCO1)C.Cl |
| Spectrum/Structure Validation Score (Raman) | 0.974636 |