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Benzoic acid, 2-[3-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)propoxy]-4-methyl-, methyl ester
SpectraBase Compound ID LDhn9CNK6mZ
InChI InChI=1S/C20H19NO5/c1-13-8-9-16(20(24)25-2)17(12-13)26-11-5-10-21-18(22)14-6-3-4-7-15(14)19(21)23/h3-4,6-9,12H,5,10-11H2,1-2H3
InChIKey BOCYPRPLADAZKG-UHFFFAOYSA-N
Mol Weight 353.37 g/mol
Molecular Formula C20H19NO5
Exact Mass 353.126323 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CwhP1l9sBg6
Name Benzoic acid, 2-[3-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)propoxy]-4-methyl-, methyl ester
CAS Registry Number 115149-48-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H19NO5
InChI InChI=1S/C20H19NO5/c1-13-8-9-16(20(24)25-2)17(12-13)26-11-5-10-21-18(22)14-6-3-4-7-15(14)19(21)23/h3-4,6-9,12H,5,10-11H2,1-2H3
InChIKey BOCYPRPLADAZKG-UHFFFAOYSA-N
Molecular Weight 353.374 g/mol
SMILES C1(N(C(c2ccccc12)=O)CCCOc1c(C(=O)OC)ccc(c1)C)=O
SPLASH splash10-000i-1900000000-6134049f9843b2e5e887
Source of Spectrum KC-1988-80-7
Synonyms Methyl 2-[3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propoxy]-4-methylbenzoate Methyl 4-methyl-2-[3-(n-phthalimido)propoxy]benzoate
Wiley ID 1343960