| SpectraBase Spectrum ID |
I4t9haQh5VS |
| Name |
Methyl 2,2'-spirobiindan-5-yl ketone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
262.135765199 u |
| Formula |
C19H18O |
| InChI |
InChI=1S/C19H18O/c1-13(20)14-6-7-17-11-19(12-18(17)8-14)9-15-4-2-3-5-16(15)10-19/h2-8H,9-12H2,1H3 |
| InChIKey |
NCSCQMYZLKWBGF-UHFFFAOYSA-N |
| Molecular Weight |
262.352 g/mol |
| SMILES |
C=12C=CC=CC1CC1(C2)CC=2C=C(C=CC2C1)C(C)=O |
| Spectrum/Structure Validation Score (Raman) |
0.864081 |
