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8-(2-Methylbuteryl)-5,7-dihydroxy-4-N-pentyl-3,4-dihydro-coumarin

View entire compound with spectra: 1 NMR, and 1 MS (GC)

8-(2-Methylbuteryl)-5,7-dihydroxy-4-N-pentyl-3,4-dihydro-coumarin
SpectraBase Compound ID 31b5bOoKRbI
InChI InChI=1S/C19H26O5/c1-4-6-7-8-12-9-15(22)24-19-16(12)13(20)10-14(21)17(19)18(23)11(3)5-2/h10-12,20-21H,4-9H2,1-3H3
InChIKey DREHJXZHUCILLE-UHFFFAOYSA-N
Mol Weight 334.41 g/mol
Molecular Formula C19H26O5
Exact Mass 334.178024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3QSflgTHTGC
Name 2H-1-Benzopyran-2-one, 3,4-dihydro-5,7-dihydroxy-8-(2-methyl-1-oxobutyl)-4-pentyl-
Alternate Name(s) 5,7-dihydroxy-8-(2-methylbutanoyl)-4-pentyl-2-chromanone 5,7-Dihydroxy-8-(2-methylbutyryl)-4-pentyl-3,4-dihydrocoumarin
CAS Registry Number 111321-15-4
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H26O5
InChI InChI=1S/C19H26O5/c1-4-6-7-8-12-9-15(22)24-19-16(12)13(20)10-14(21)17(19)18(23)11(3)5-2/h10-12,20-21H,4-9H2,1-3H3
InChIKey DREHJXZHUCILLE-UHFFFAOYSA-N
Molecular Weight 334.412 g/mol
SMILES Oc1cc(c2c(c1C(=O)C(CC)C)OC(CC2CCCCC)=O)O
SPLASH splash10-004i-0091000000-5a0fe22a87682ac8b26e
Source of Spectrum KC-1987-348-2
Wiley ID 1330978