SpectraBase Spectrum ID |
GE5iaPDDHAt |
Name |
1,3-Dihydroxy-7,8,9,10-tetrahydro-6H-benzo[C]chromen-6-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
232.073558862 u |
Formula |
C13H12O4 |
InChI |
InChI=1S/C13H12O4/c14-7-5-10(15)12-8-3-1-2-4-9(8)13(16)17-11(12)6-7/h5-6,14-15H,1-4H2 |
InChIKey |
WHOXXIZKHZBTOB-UHFFFAOYSA-N |
Molecular Weight |
232.235 g/mol |
SMILES |
C1=2OC(C3=C(C2C(=CC(=C1)O)O)CCCC3)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.813727 |