![cis-4a,5,cis-4a,9b-7-methoxy-4,4a,5,9b-tetrahydro-5-p-tolyl-1H-indeno[1,2-b]pyridin-2(3H)-one](/api/spectrum/9N0PGHsxQaU/structure.png?h=300&w=458 "cis-4a,5,cis-4a,9b-7-methoxy-4,4a,5,9b-tetrahydro-5-p-tolyl-1H-indeno[1,2-b]pyridin-2(3H)-one")
| SpectraBase Compound ID | Be6FcwpHRUG |
|---|---|
| InChI | InChI=1S/C20H21NO2/c1-12-3-5-13(6-4-12)19-16-9-10-18(22)21-20(16)15-8-7-14(23-2)11-17(15)19/h3-8,11,16,19-20H,9-10H2,1-2H3,(H,21,22)/t16-,19+,20+/m1/s1 InChI=1S/C20H21NO2/c1-12-3-5-13(6-4-12)19-16-9-10-18(22)21-20(16)15-8-7-14(23-2)11-17(15)19/h3-8,11,16,19-20H,9-10H2,1-2H3,(H,21,22)/t16-,19+,20+/m0/s1 |
| InChIKey | SVWWBSSLKWEGMK-UXPWSPDFSA-N |
| Mol Weight | 307.39 g/mol |
| Molecular Formula | C20H21NO2 |
| Exact Mass | 307.157229 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 9N0PGHsxQaU |
|---|---|
| Name | cis-4A,5,cis-4A,9B-7-Methoxy-4,4A,5,9B-tetrahydro-5-p-tolyl-1H-indeno[1,2-B]pyridin-2(3H)-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 307.157228918 u |
| Formula | C20H21NO2 |
| InChI | InChI=1S/C20H21NO2/c1-12-3-5-13(6-4-12)19-16-9-10-18(22)21-20(16)15-8-7-14(23-2)11-17(15)19/h3-8,11,16,19-20H,9-10H2,1-2H3,(H,21,22)/t16-,19+,20+/m1/s1 |
| InChIKey | SVWWBSSLKWEGMK-UXPWSPDFSA-N |
| Molecular Weight | 307.393 g/mol |
| SMILES | N1[C@]2(C=3C=CC(=CC3[C@]([C@]2(CCC1=O)[H])(C1=CC=C(C=C1)C)[H])OC)[H] |
| Spectrum/Structure Validation Score (Raman) | 0.853525 |