| SpectraBase Compound ID | 8Yp5RSREd0G |
|---|---|
| InChI | InChI=1S/C19H24ClNO4/c1-12-3-4-15-13(11-12)19(2)7-5-14(22)17(18(19)25-15)21-16(23)6-9-24-10-8-20/h3-4,11,17-18H,5-10H2,1-2H3,(H,21,23)/t17-,18-,19-/m1/s1 InChI=1S/C19H24ClNO4/c1-12-3-4-15-13(11-12)19(2)7-5-14(22)17(18(19)25-15)21-16(23)6-9-24-10-8-20/h3-4,11,17-18H,5-10H2,1-2H3,(H,21,23)/t17-,18-,19-/m0/s1 |
| InChIKey | XDCZLUFKPZRORQ-GUDVDZBRSA-N |
| Mol Weight | 365.86 g/mol |
| Molecular Formula | C19H24ClNO4 |
| Exact Mass | 365.139386 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 2PiTOpj0Vvc |
|---|---|
| Name | 3-(2-Chloroethoxy)-N-(8,9bbeta-dimethyl-1,2,3,4,4abeta,9B-hexahydro-3-oxo-4A-dibenzofuranyl)propionamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 365.139385953 u |
| Formula | C19H24ClNO4 |
| InChI | InChI=1S/C19H24ClNO4/c1-12-3-4-15-13(11-12)19(2)7-5-14(22)17(18(19)25-15)21-16(23)6-9-24-10-8-20/h3-4,11,17-18H,5-10H2,1-2H3,(H,21,23)/t17-,18-,19-/m1/s1 |
| InChIKey | XDCZLUFKPZRORQ-GUDVDZBRSA-N |
| Molecular Weight | 365.857 g/mol |
| SMILES | N([C@]1([C@]2(OC=3C=CC(=CC3[C@]2(CCC1=O)C)C)[H])[H])C(CCOCCCl)=O |
| Spectrum/Structure Validation Score (Raman) | 0.799104 |