SpectraBase Spectrum ID |
490KWIAgFPv |
Name |
6,6-Dimethyl-2-phenyl-5,7-dioxaspiro[2.5]octane-4,8-dione |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
246.089208927 u |
Formula |
C14H14O4 |
InChI |
InChI=1S/C14H14O4/c1-13(2)17-11(15)14(12(16)18-13)8-10(14)9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3 |
InChIKey |
RJSCODSWRYREHR-UHFFFAOYSA-N |
Molecular Weight |
246.262 g/mol |
SMILES |
C1(CC11C(OC(OC1=O)(C)C)=O)C=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.972413 |