SpectraBase Spectrum ID |
Iaxgyljn0LQ |
Name |
Spiro[naphthalene-1(2H),2'-oxiran]-2-one, 3'-acetyl-3'-methyl-, cis-(+)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
228.078644243 u |
Formula |
C14H12O3 |
InChI |
InChI=1S/C14H12O3/c1-9(15)13(2)14(17-13)11-6-4-3-5-10(11)7-8-12(14)16/h3-8H,1-2H3 |
InChIKey |
RYQVPNYYLXBCST-UHFFFAOYSA-N |
Molecular Weight |
228.247 g/mol |
SMILES |
C1(OC11C2=C(C=CC1=O)C=CC=C2)(C(C)=O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.971379 |