For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
5-Hydroxy-8-(2-hydroxypropan-2-yl)-6-(1-oxobutyl)-4-propyl-8,9-dihydrofuro[2,3-h][1]benzopyran-2-one
SpectraBase Compound ID H1MYirxjLXx
InChI InChI=1S/C21H26O6/c1-5-7-11-9-15(23)27-19-12-10-14(21(3,4)25)26-20(12)17(13(22)8-6-2)18(24)16(11)19/h9,14,24-25H,5-8,10H2,1-4H3
InChIKey AHRWRZGWPYCGMI-UHFFFAOYSA-N
Mol Weight 374.43 g/mol
Molecular Formula C21H26O6
Exact Mass 374.172939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID B3otiThZX2i
Name 5-Hydroxy-8-(2-hydroxypropan-2-yl)-6-(1-oxobutyl)-4-propyl-8,9-dihydrofuro[2,3-h][1]benzopyran-2-one
CAS Registry Number 111761-49-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26O6
InChI InChI=1S/C21H26O6/c1-5-7-11-9-15(23)27-19-12-10-14(21(3,4)25)26-20(12)17(13(22)8-6-2)18(24)16(11)19/h9,14,24-25H,5-8,10H2,1-4H3
InChIKey AHRWRZGWPYCGMI-UHFFFAOYSA-N
Molecular Weight 374.433 g/mol
SMILES Oc1c(c2c(CC(C(O)(C)C)O2)c2c1C(=CC(O2)=O)CCC)C(=O)CCC
SPLASH splash10-00di-0009000000-ef6403a9527f17474a5a
Source of Spectrum KC-1987-330-5
Synonyms 6-Butanoyl-5-hydroxy-8-(1-hydroxy-1-methyl-ethyl)-4-propyl-8,9-dihydrofuro[2,3-h]chromen-2-one 6-Butanoyl-5-hydroxy-8-(2-hydroxypropan-2-yl)-4-propyl-8,9-dihydrofuro[2,3-h]chromen-2-one 6-Butanoyl-5-oxidanyl-8-(2-oxidanylpropan-2-yl)-4-propyl-8,9-dihydrofuro[2,3-h]chromen-2-one 6-Butyryl-5-hydroxy-8-(1-hydroxy-1-methyl-ethyl)-4-propyl-8,9-dihydrofuro[2,3-h]chromen-2-one
Wiley ID 1356649