Columbianetin

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Systematic / IUPAC Name: 8-(2-Hydroxy-2-propanyl)-8,9-dihydro-2H-furo[2,3-H]chromen-2-one

ID: Reference7949

Other Names: 2H-Furo[2,3-H]-1-benzopyran-2-one, 8,9-dihydro-8-(1-hydroxy-1-methylethyl)- ;
8-(1-Hydroxy-1-methylethyl)-8,9-dihydro-2H-furo[2,3-H]chromen-2-one;
8-(2-Hydroxypropan-2-yl)-8,9-dihydro-2H-furo[2,3-H]chromen-2-one;
8,9-Dihydro-8-(1-hydroxy-1-methylethyl)-2H-furo[2,3-H]1-benzopyran-2-one

Formula: C14H14O4

Spectral Data

Columbianetin mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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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 5/14/2018 2:26:17 PM
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Identificators

InChI InChI=1S/C14H14O4/c1-14(2,16)11-7-9-10(17-11)5-3-8-4-6-12(15)18-13(8)9/h3-6,11,16H,7H2,1-2H3
InChI Key YRAQEMCYCSSHJG-UHFFFAOYSA-N
Canonical SMILES CC(C)(C1CC2=C(O1)C=CC3=C2OC(=O)C=C3)O
CAS
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Other Names 2H-Furo[2,3-H]-1-benzopyran-2-one, 8,9-dihydro-8-(1-hydroxy-1-methylethyl)- ;
8-(1-Hydroxy-1-methylethyl)-8,9-dihydro-2H-furo[2,3-H]chromen-2-one;
8-(2-Hydroxypropan-2-yl)-8,9-dihydro-2H-furo[2,3-H]chromen-2-one;
8,9-Dihydro-8-(1-hydroxy-1-methylethyl)-2H-furo[2,3-H]1-benzopyran-2-one

In Other Databases

PubChem 150888
KEGG C09210
ChEBI CHEBI:59948
ChemSpider 132991
ChemIDPlus 001147291; 1147291; 3804704