SpectraBase Compound ID | 4eGSB7vuiXq |
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InChI | InChI=1S/C10H8O4/c1-5-2-7(12)10-8(13)3-6(11)4-9(10)14-5/h2-4,11,13H,1H3 |
InChIKey | NCUJRUDLFCGVOE-UHFFFAOYSA-N |
Mol Weight | 192.17 g/mol |
Molecular Formula | C10H8O4 |
Exact Mass | 192.042259 g/mol |
SpectraBase Spectrum ID | 2oQet1p2njH |
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Name | Noreugenin |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 192.042258734 u |
Formula | C10H8O4 |
InChI | InChI=1S/C10H8O4/c1-5-2-7(12)10-8(13)3-6(11)4-9(10)14-5/h2-4,11,13H,1H3 |
InChIKey | NCUJRUDLFCGVOE-UHFFFAOYSA-N |
Molecular Weight | 192.170 g/mol |
SMILES | C1=2OC(=CC(C2C(=CC(=C1)O)O)=O)C |
Spectrum/Structure Validation Score (Raman) | 0.722617 |