9-(2,3-Dihydroxy-3-methylbutoxy)-7H-furo[3,2-g]chromen-7-one

enlarge

Systematic / IUPAC Name: 9-(2,3-Dihydroxy-3-methylbutoxy)furo[3,2-g]chromen-7-one

ID: Reference7767

Other Names: Heraclenol;
9-(2,3-Dihydroxy-3-methylbutoxy)-2H-furo[3,2-g]chromen-2-one;
7H-Furo[3,2-g][1]benzopyran-7-one,9-[(2R)-2,3-dihydroxy-3-methylbutoxy]-;
7H-Furo[3,2-g][1]benzopyran-7-one, 9-(2,3-dihydroxy-3-methylbutoxy)-

Formula: C16H16O6

Spectral Data

9-(2,3-Dihydroxy-3-methylbutoxy)-7H-furo[3,2-g]chromen-7-one mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP FAIMS
No. of Spectral Trees 1
No. of Spectra 162
Tandem Spectra MS1, MS2
Ionization Methods NSI
Analyzers FT
Last Modification 4/13/2018 8:58:21 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C16H16O6/c1-16(2,19)11(17)8-21-15-13-10(5-6-20-13)7-9-3-4-12(18)22-14(9)15/h3-7,11,17,19H,8H2,1-2H3
InChI Key FOINLJRVEBYARJ-UHFFFAOYSA-N
Canonical SMILES CC(C)(C(COC1=C2C(=CC3=C1OC=C3)C=CC(=O)O2)O)O
CAS
Splash
Other Names Heraclenol;
9-(2,3-Dihydroxy-3-methylbutoxy)-2H-furo[3,2-g]chromen-2-one;
7H-Furo[3,2-g][1]benzopyran-7-one,9-[(2R)-2,3-dihydroxy-3-methylbutoxy]-;
7H-Furo[3,2-g][1]benzopyran-7-one, 9-(2,3-dihydroxy-3-methylbutoxy)-

In Other Databases

ChemSpider 290709
PubChem 328236
ChEBI CHEBI:93899
HMDb HMDB30745