| SpectraBase Spectrum ID |
47embP0CDKq |
| Name |
jwh 122 8-Methylnaphthyl isomer |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
355.193614428 u |
| Formula |
C25H25NO |
| InChI |
InChI=1S/C25H25NO/c1-3-4-7-16-26-17-22(20-13-5-6-15-23(20)26)25(27)21-14-9-12-19-11-8-10-18(2)24(19)21/h5-6,8-15,17H,3-4,7,16H2,1-2H3 |
| InChIKey |
NMSMHEOGZBXQDF-UHFFFAOYSA-N |
| Molecular Weight |
355.481 g/mol |
| SMILES |
C=12C(=CC=CC1C=CC=C2C(C=1C=2C=CC=CC2N(C1)CCCCC)=O)C |
| Spectrum/Structure Validation Score (Raman) |
0.984987 |
