| SpectraBase Spectrum ID |
4xDs5biXbG1 |
| Name |
(Trans-1-methyl-2,3-dihydro-1H-inden-3-yl)(phenyl)methanone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
236.120115134 u |
| Formula |
C17H16O |
| InChI |
InChI=1S/C17H16O/c1-12-11-16(15-10-6-5-9-14(12)15)17(18)13-7-3-2-4-8-13/h2-10,12,16H,11H2,1H3/t12-,16-/m0/s1 |
| InChIKey |
YPVCZXBMZBTNOE-LRDDRELGSA-N |
| Molecular Weight |
236.314 g/mol |
| SMILES |
[C@@]1(C2=C(C=CC=C2)[C@](C1)(C)[H])(C(=O)C=1C=CC=CC1)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.944797 |
