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Angelicin
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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1xQmZiyYJ3b
Name 2H-Furo[2,3-h]-1-benzopyran-2-one
Alternate Name(s) Isopsoralen 2H-Furo[2,3-h]chromen-2-one 2-furo[2,3-h][1]benzopyranone 2-Propenoic acid, 3-(4-hydroxy-5-benzofuranyl)-, .delta.-lactone 2-Propenoic acid, 3-(4-hydroxy-5-benzofuranyl)-, delta-lactone 3-(4-Hydroxy-5-benzofuranyl)-2-propenoic acid .gamma.-lactone 3-(4-Hydroxy-5-benzofuranyl)-2-propenoic acid gamma-lactone 4-Hydroxy-5-benzofuranacrylic acid .gamma.-lactone 4-Hydroxy-5-benzofuranacrylic acid gamma-lactone Angecin Angelecin Angelicin Angelicin (coumarin deriv) Angelicin (coumarin derivative) Furo(2,3-h)coumarin Furo(5',4',7,8)coumarin furo[2,3-h]chromen-2-one Isopsoralin BRN 0153970 CCRIS 4276 HSDB 3554 NSC 404563
CAS Registry Number 523-50-2
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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
Molecular Weight 186.166 g/mol
SMILES C1(=O)Oc2c3c(ccc2C=C1)occ3
SPLASH splash10-0zfr-9700000000-e2da89864e35bf20aba4
Source of Spectrum CD-357-0-0
Wiley ID 1182972