SpectraBase Spectrum ID |
Bm1ZaANFNL7 |
Name |
2,7-bis-(3-Methylbuthoxy)-fluorene-9-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
352.203844759 u |
Formula |
C23H28O3 |
InChI |
InChI=1S/C23H28O3/c1-15(2)9-11-25-17-5-7-19-20-8-6-18(26-12-10-16(3)4)14-22(20)23(24)21(19)13-17/h5-8,13-16H,9-12H2,1-4H3 |
InChIKey |
BUMPYXXADFKYSJ-UHFFFAOYSA-N |
Molecular Weight |
352.474 g/mol |
SMILES |
C1=2C(C3=CC(OCCC(C)C)=CC=C3C2C=CC(=C1)OCCC(C)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.951918 |