Imperatorin

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Systematic / IUPAC Name: 9-[(3-Methyl-2-buten-1-yl)oxy]-7H-furo[3,2-g]chromen-7-one

ID: Reference7736

Other Names: 8-Isoamylenoxypsoralen;
8-Isopentenyloxypsoralene;
Ammidin;
Marmelide;
Marmelosin ; more

Formula: C16H14O4

Spectral Data

Imperatorin 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 4/10/2018 8:03:52 AM
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Identificators

InChI InChI=1S/C16H14O4/c1-10(2)5-7-19-16-14-12(6-8-18-14)9-11-3-4-13(17)20-15(11)16/h3-6,8-9H,7H2,1-2H3
InChI Key OLOOJGVNMBJLLR-UHFFFAOYSA-N
Canonical SMILES CC(=CCOC1=C2C(=CC3=C1OC=C3)C=CC(=O)O2)C
CAS 482440
Splash
Other Names 8-Isoamylenoxypsoralen;
8-Isopentenyloxypsoralene;
Ammidin;
Marmelide;
Marmelosin;
Pentosalen;
5-Benzofuranacrylic acid, 6-hydroxy-7-[(3-methyl-2-butenyl)oxy]-, δ-lactone ;
5-Hydroxy-8-(1,1-dimethylallyl)psoralen;
6-Hydroxy-7-(3-methyl-2-butenyloxy)-5-benzofuranacrylic acid ω-lactone;
7H-Furo[3,2-g][1]benzopyran-7-one, 9-[(3-methyl-2-buten-1-yl)oxy]-;
7H-Furo[3,2-g][1]benzopyran-7-one, 9-[(3-methyl-2-butenyl)oxy]-;
9-(3-Methyl-2-butenyloxy)-7-oxofuro[3,2-g]chromene;
9-(3-Methylbut-2-enoxy)-7-furo[3,2-g][1]benzopyranone;
9-(3-Methylbut-2-enoxy)furo[3,2-g]chromen-7-one;
9-(3-Methylbut-2-enyloxy)-7H-furo(3,2-g)chromen-7-one;
9-(3-Methylbut-2-enyloxy)furo[3,2-g]chromen-7-one;
9-[(3-Methyl-2-butenyl)oxy]-7H-furo[3,2-g]-1-benzopyran-7-one;
9-[(3-Methylbut-2-en-1-yl)oxy]-7H-furo[3,2-g]chromen-7-one

In Other Databases

ChEMBL CHEMBL453805
Wikipedia Imperatorin
HMDb HMDB34376
KEGG C09269
ChemSpider 9797
PubChem 10212
ChemIDPlus 000482440
ChEBI CHEBI:5885