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Marmesin - caprate
SpectraBase Compound ID LsVy7FhyRAx
InChI InChI=1S/C24H32O5/c1-4-5-6-7-8-9-10-11-23(26)29-24(2,3)21-15-18-14-17-12-13-22(25)28-19(17)16-20(18)27-21/h12-14,16,21H,4-11,15H2,1-3H3
InChIKey GTVIYLAEJIJOQZ-UHFFFAOYSA-N
Mol Weight 400.5 g/mol
Molecular Formula C24H32O5
Exact Mass 400.224974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D2nZlHzyy
Name Marmesin - caprate
Alternate Name(s) 7-[1'-Methyl-1'-(decanoyloxy)ethyl]-furo[2,3-7',8']benzopyran-2(2H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H32O5
InChI InChI=1S/C24H32O5/c1-4-5-6-7-8-9-10-11-23(26)29-24(2,3)21-15-18-14-17-12-13-22(25)28-19(17)16-20(18)27-21/h12-14,16,21H,4-11,15H2,1-3H3
InChIKey GTVIYLAEJIJOQZ-UHFFFAOYSA-N
Molecular Weight 400.515 g/mol
SMILES c12OC(Cc2cc2c(c1)OC(=O)C=C2)C(OC(=O)CCCCCCCCC)(C)C
SPLASH splash10-01t9-0490000000-0e98d94972a8179d23f2
Source of Spectrum X4-12-587-0
Wiley ID 1585098