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3-[(1,3-Dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl]benzoic acid

View entire compound with spectra: 2 MS (GC)

3-[(1,3-Dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl]benzoic acid
SpectraBase Compound ID HOUNpBHlIV1
InChI InChI=1S/C16H11NO4/c18-14-12-6-1-2-7-13(12)15(19)17(14)9-10-4-3-5-11(8-10)16(20)21/h1-8H,9H2,(H,20,21)
InChIKey ZUWJKVVWOLYFRK-UHFFFAOYSA-N
Mol Weight 281.27 g/mol
Molecular Formula C16H11NO4
Exact Mass 281.068808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DZs0zEvh7SM
Name 3-[(1,3-Dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl]benzoic acid
CAS Registry Number 106352-01-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H11NO4
InChI InChI=1S/C16H11NO4/c18-14-12-6-1-2-7-13(12)15(19)17(14)9-10-4-3-5-11(8-10)16(20)21/h1-8H,9H2,(H,20,21)
InChIKey ZUWJKVVWOLYFRK-UHFFFAOYSA-N
Molecular Weight 281.267 g/mol
SMILES OC(c1cccc(c1)CN1C(c2c(C1=O)cccc2)=O)=O
SPLASH splash10-0fb9-9300000000-7d5df3684273011039d2
Synonyms 3-(Phthalimidomethyl)benzoic acid 3-[(1,3-dioxo-2-isoindolyl)methyl]benzoic acid 3-[(1,3-dioxoisoindol-2-yl)methyl]benzoic acid 3-[(1,3-dioxoisoindolin-2-yl)methyl]benzoic acid 3-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]benzoic acid
Wiley ID 1469702