SpectraBase Spectrum ID |
LG5CSW08pty |
Name |
Methyl naphtho[2,3-D]-(1,3)-dioxole-7,8-dihydro-5-methoxy-6-carboxylate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
262.084123546 u |
Formula |
C14H14O5 |
InChI |
InChI=1S/C14H14O5/c1-16-13-9(14(15)17-2)4-3-8-5-11-12(6-10(8)13)19-7-18-11/h5-6H,3-4,7H2,1-2H3 |
InChIKey |
CEQODEKKDKUEDG-UHFFFAOYSA-N |
Molecular Weight |
262.261 g/mol |
SMILES |
C1(=C(C2=CC=3OCOC3C=C2CC1)OC)C(=O)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.886582 |