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Ethyl 4-(4-n-Butyl-6,8-dimethyl-1-oxo-1H-isochromen-3-yl)benzoate
SpectraBase Compound ID 49Mx3Aycve3
InChI InChI=1S/C24H26O4/c1-5-7-8-19-20-14-15(3)13-16(4)21(20)24(26)28-22(19)17-9-11-18(12-10-17)23(25)27-6-2/h9-14H,5-8H2,1-4H3
InChIKey XNOLFKGWQKVCLQ-UHFFFAOYSA-N
Mol Weight 378.47 g/mol
Molecular Formula C24H26O4
Exact Mass 378.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CQgsAedL9gA
Name Ethyl 4-(4-n-Butyl-6,8-dimethyl-1-oxo-1H-isochromen-3-yl)benzoate
Alternate Name(s) Ethyl 4-(4-butyl-6,8-dimethyl-1-oxo-1H-isochromen-3-yl)benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H26O4
InChI InChI=1S/C24H26O4/c1-5-7-8-19-20-14-15(3)13-16(4)21(20)24(26)28-22(19)17-9-11-18(12-10-17)23(25)27-6-2/h9-14H,5-8H2,1-4H3
InChIKey XNOLFKGWQKVCLQ-UHFFFAOYSA-N
Molecular Weight 378.468 g/mol
SMILES C=1(OC(c2c(cc(cc2C1CCCC)C)C)=O)c1ccc(cc1)C(OCC)=O
SPLASH splash10-01t9-0169000000-d1a20e06c3207e8af669
Source of Spectrum ACI-54-5513/SMS35-3gj
Wiley ID 1761166