| SpectraBase Compound ID | 8ARVHTbKzNr |
|---|---|
| InChI | InChI=1S/C18H25NO/c1-19-12-11-15-5-3-4-6-17(15)18(19)13-14-7-9-16(20-2)10-8-14/h7-10,18H,3-6,11-13H2,1-2H3 |
| InChIKey | CRXXSGLBECOUQH-UHFFFAOYSA-N |
| Mol Weight | 271.4 g/mol |
| Molecular Formula | C18H25NO |
| Exact Mass | 271.193614 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | d1UYErbKfU |
|---|---|
| Name | 1-(4-Methoxybenzyl)-N-methyl-1,2,3,4,5,6,7,8-octahydroisoquinoline; isoquinoline, 1,2,3,4,5,6,7,8-octahydro-1-[(4-methoxyphenyl)methyl]-2-methyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 271.193614428 u |
| Formula | C18H25NO |
| InChI | InChI=1S/C18H25NO/c1-19-12-11-15-5-3-4-6-17(15)18(19)13-14-7-9-16(20-2)10-8-14/h7-10,18H,3-6,11-13H2,1-2H3 |
| InChIKey | CRXXSGLBECOUQH-UHFFFAOYSA-N |
| Molecular Weight | 271.404 g/mol |
| SMILES | C1(C=2CCCCC2CCN1C)CC1=CC=C(C=C1)OC |
| Spectrum/Structure Validation Score (Raman) | 0.987519 |