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Khellin

View entire compound with spectra: 14 NMR, 6 FTIR, and 3 MS (GC)

Khellin
SpectraBase Compound ID GGHbvlVLbwD
InChI InChI=1S/C14H12O5/c1-7-6-9(15)10-11(16-2)8-4-5-18-12(8)14(17-3)13(10)19-7/h4-6H,1-3H3
InChIKey HSMPDPBYAYSOBC-UHFFFAOYSA-N
Mol Weight 260.24 g/mol
Molecular Formula C14H12O5
Exact Mass 260.068473 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9cjnlpbW12I
Name 5H-Furo[3,2-g][1]benzopyran-5-one, 4,9-dimethoxy-7-methyl-
CAS Registry Number 82-02-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12O5
InChI InChI=1S/C14H12O5/c1-7-6-9(15)10-11(16-2)8-4-5-18-12(8)14(17-3)13(10)19-7/h4-6H,1-3H3
InChIKey HSMPDPBYAYSOBC-UHFFFAOYSA-N
Molecular Weight 260.245 g/mol
SMILES COc1c2c(c(OC)c3c1cco3)OC(=CC2=O)C
SPLASH splash10-0292-3390000000-f5a1a02900a93cd9dfb9
Source of Spectrum AD-0-776-0
Synonyms 4,9-Dimethoxy-7-methyl-5-furo[3,2-g][1]benzopyranone 4,9-Dimethoxy-7-methyl-5-oxo-1,8-dioxabenz-(f)indene 4,9-Dimethoxy-7-methyl-5-oxofuro(3,2-g)(1)benzopyran 4,9-Dimethoxy-7-methyl-5-oxofuro(3,2-g)-1,2-chromene 4,9-Dimethoxy-7-methyl-5H-furo[3,2-g]-[1]benzopyran-5-one 4,9-Dimethoxy-7-methyl-5H-furo[3,2-g]chromen-5-one 4,9-Dimethoxy-7-methyl-furo[3,2-g]chromen-5-one 5,8-Dimethoxy-2-methyl-4',5'-furano-6,7-chromone 5,8-Dimethoxy-2-methyl-4',5'-furo-6,7-chromone 5,8-Dimethoxy-2-methyl-6,7-furanochromone Amicardine Amikellin Amiptan Ammi-khellin Ammicardine Ammipuran Ammispasmin Ammivin Ammivisnagen Benecardin Benekardin Bi-Kellina Cardio-khellin Chellin Chellina Chorafurone Corafurone Coronin Deltoside Eskel Gynokhellan Intercellin Interkellin Interkhellin IT-033 Kalangin Kelamin Kelicor Kelicorin Kelincor Kellin Kellina Kellosal Keloid Kelourin Khelangin Khelfren Khelisem Khell Khellamine Khellanals Khellin Khelline Khelline I Khellinorm Khellinum Khelloyd Lynamine Medekellin Mefurina Methafrone Norkel Quelina Rykellin Simeskellina Vasokellina Visammimix Visammin Viscardan Viscardin Vismagen Visnagalin Visnagen AI3-52114 BRN 0263185 EINECS 201-392-8 NSC 25509 NSC 37744
Wiley ID 37153