| SpectraBase Spectrum ID |
JyPyiQ3Ap18 |
| Name |
Esculetin |
| Source of Sample |
Cayman Chemical Company |
| Catalog Number |
19286 |
| Lot Number |
0486815-19 |
| Accessory |
DurasamplIR II |
| CAS Registry Number |
305-01-1 |
| Copyright |
Copyright © 2019-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
178.026608669 u |
| Formula |
C9H6O4 |
| InChI |
InChI=1S/C9H6O4/c10-6-3-5-1-2-9(12)13-8(5)4-7(6)11/h1-4,10-11H |
| InChIKey |
ILEDWLMCKZNDJK-UHFFFAOYSA-N |
| Instrument Name |
Bio-Rad FTS |
| Molecular Weight |
178.143 g/mol |
| Purity |
≥98% |
| Resolution |
4 |
| SMILES |
C1(C=CC=2C(O1)=CC(=C(C2)O)O)=O |
| Scan Speed (number) |
5 |
| Source of Spectrum |
Forensic Spectral Research |
| Synonyms |
6,7-dihydroxy-2H-1-benzopyran-2-one
6,7-Dihydroxycoumarin
Aesculetin
Cichorigenin
NSC 26427 |
| Technique |
ATR-Neat |
