SpectraBase Spectrum ID |
CSD5lYJZ8Vy |
Name |
cis-1,2-Dihydro-1,2-diacetoxynaphtho[2,1-B]furan |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
286.084123546 u |
Formula |
C16H14O5 |
InChI |
InChI=1S/C16H14O5/c1-9(17)19-15-14-12-6-4-3-5-11(12)7-8-13(14)21-16(15)20-10(2)18/h3-8,15-16H,1-2H3/t15-,16+/m1/s1 |
InChIKey |
LNQLYCXBSKSXRH-CVEARBPZSA-N |
SMILES |
C=12[C@]([C@@](OC(=O)C)(OC2=CC=C2C1C=CC=C2)[H])(OC(=O)C)[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.883116 |