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Benzoic acid, 4-[5-hydroxy-2-(methoxycarbonyl)-3-methylphenoxy]-2-methoxy-6-methyl-, phenylmethyl ester
SpectraBase Compound ID 8KT2saU3JFR
InChI InChI=1S/C25H24O7/c1-15-10-18(26)12-21(23(15)24(27)30-4)32-19-11-16(2)22(20(13-19)29-3)25(28)31-14-17-8-6-5-7-9-17/h5-13,26H,14H2,1-4H3
InChIKey CBAMGMIIPDJBOW-UHFFFAOYSA-N
Mol Weight 436.46 g/mol
Molecular Formula C25H24O7
Exact Mass 436.152203 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FNVnIVlpOb5
Name Benzoic acid, 4-[5-hydroxy-2-(methoxycarbonyl)-3-methylphenoxy]-2-methoxy-6-methyl-, phenylmethyl ester
Alternate Name(s) Methyl 2-(4'-benzyoxycarbonyl-3'-methoxy-5'-methylphenoxy)-4-hydroxy-6-methylbenzoate methyl 2-{4-[(benzyloxy)carbonyl]-3-methoxy-5-methylphenoxy}-4-hydroxy-6-methylbenzoate
CAS Registry Number 132281-69-7
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H24O7
InChI InChI=1S/C25H24O7/c1-15-10-18(26)12-21(23(15)24(27)30-4)32-19-11-16(2)22(20(13-19)29-3)25(28)31-14-17-8-6-5-7-9-17/h5-13,26H,14H2,1-4H3
InChIKey CBAMGMIIPDJBOW-UHFFFAOYSA-N
Molecular Weight 436.460 g/mol
SMILES Oc1cc(c(c(Oc2cc(OC)c(c(c2)C)C(OCc2ccccc2)=O)c1)C(=O)OC)C
SPLASH splash10-0006-9000100000-8cc8396bbc054eeb3048
Source of Spectrum B-43-2110-10
Wiley ID 1383542