| SpectraBase Spectrum ID |
IuG94upRAC9 |
| Name |
Isobergapten |
| Source of Sample |
Cayman Chemical Company |
| Catalog Number |
34141 |
| Lot Number |
0614933-2 |
| Accessory |
DurasamplIR II |
| CAS Registry Number |
482-48-4 |
| Copyright |
Copyright © 2019-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
216.042258734 u |
| Formula |
C12H8O4 |
| InChI |
InChI=1S/C12H8O4/c1-14-9-6-10-8(4-5-15-10)12-7(9)2-3-11(13)16-12/h2-6H,1H3 |
| InChIKey |
AJSPSRWWZBBIOR-UHFFFAOYSA-N |
| Instrument Name |
Bio-Rad FTS |
| Molecular Weight |
216.192 g/mol |
| Purity |
≥98% |
| Resolution |
4 |
| SMILES |
C1(C=CC2=C(O1)C1=C(C=C2OC)OC=C1)=O |
| Scan Speed (number) |
5 |
| Source of Spectrum |
Forensic Spectral Research |
| Synonyms |
5-methoxy-2H-furo[2,3-h]-1-benzopyran-2-one
5-methoxy Angelicin |
| Technique |
ATR-Neat |
