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2H-furo[2,3-h]-1-benzopyran-2-one
SpectraBase Compound ID 2xfDJ263aAq
InChI InChI=1S/C11H6O3/c12-10-4-2-7-1-3-9-8(5-6-13-9)11(7)14-10/h1-6H
InChIKey XDROKJSWHURZGO-UHFFFAOYSA-N
Mol Weight 186.17 g/mol
Molecular Formula C11H6O3
Exact Mass 186.031694 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID Af7YqujXO2b
Name Angelicin
Source of Sample Cayman Chemical Company
Catalog Number 11683
Lot Number 0614319-5
Accessory DurasamplIR II
CAS Registry Number 523-50-2
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Exact Mass 186.031694050 u
Formula C11H6O3
InChI InChI=1S/C11H6O3/c12-10-4-2-7-1-3-9-8(5-6-13-9)11(7)14-10/h1-6H
InChIKey XDROKJSWHURZGO-UHFFFAOYSA-N
Instrument Name Bio-Rad FTS
Molecular Weight 186.166 g/mol
Purity ≥98%
Resolution 4
SMILES C1(C=CC2=C(O1)C1=C(C=C2)OC=C1)=O
Scan Speed (number) 5
Source of Spectrum Forensic Spectral Research
Synonyms 2H-furo[2,3-h]-1-benzopyran-2-one Bakuchicin NSC 404563
Technique ATR-Neat