SpectraBase Spectrum ID |
2M6huLelYPP |
Name |
1H-Inden-1-one, 2,3-dihydro-7-(phenylmethoxy)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
238.099379689 u |
Formula |
C16H14O2 |
InChI |
InChI=1S/C16H14O2/c17-14-10-9-13-7-4-8-15(16(13)14)18-11-12-5-2-1-3-6-12/h1-8H,9-11H2 |
InChIKey |
SCTSWSXQDNISSX-UHFFFAOYSA-N |
Molecular Weight |
238.286 g/mol |
SMILES |
C1=2C(CCC2C=CC=C1OCC=1C=CC=CC1)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.898311 |