| SpectraBase Spectrum ID |
LI4OzwHfLN0 |
| Name |
Benzaldehyde, 5-[3,4-dihydro-7-(methoxymethoxy)-2H-1-benzopyran-3-yl]-4-hydroxy-2-methoxy-, (S)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
344.125988358 u |
| Formula |
C19H20O6 |
| InChI |
InChI=1S/C19H20O6/c1-22-11-25-15-4-3-12-5-14(10-24-19(12)7-15)16-6-13(9-20)18(23-2)8-17(16)21/h3-4,6-9,14,21H,5,10-11H2,1-2H3/t14-/m1/s1 |
| InChIKey |
BZCVREPVBCKGPZ-CQSZACIVSA-N |
| Molecular Weight |
344.363 g/mol |
| SMILES |
C=1(C=C(C=O)C(=CC1O)OC)[C@@]1(CC2=CC=C(C=C2OC1)OCOC)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.946323 |
![Benzaldehyde, 5-[3,4-dihydro-7-(methoxymethoxy)-2H-1-benzopyran-3-yl]-4-hydroxy-2-methoxy-, (S)-](/api/spectrum/LI4OzwHfLN0/structure.png?h=300&w=458 "Benzaldehyde, 5-[3,4-dihydro-7-(methoxymethoxy)-2H-1-benzopyran-3-yl]-4-hydroxy-2-methoxy-, (S)-")
