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Benzoic acid, 2-[3-[[(3,4-dihydroxyphenyl)acetyl]amino]propoxy]-
SpectraBase Compound ID 1NRPB1gbVgN
InChI InChI=1S/C18H19NO6/c20-14-7-6-12(10-15(14)21)11-17(22)19-8-3-9-25-16-5-2-1-4-13(16)18(23)24/h1-2,4-7,10,20-21H,3,8-9,11H2,(H,19,22)(H,23,24)
InChIKey JNFLVOOGBDGMAX-UHFFFAOYSA-N
Mol Weight 345.35 g/mol
Molecular Formula C18H19NO6
Exact Mass 345.121237 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8ze5jbRGG3T
Name Benzoic acid, 2-[3-[[(3,4-dihydroxyphenyl)acetyl]amino]propoxy]-
CAS Registry Number 115149-65-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H19NO6
InChI InChI=1S/C18H19NO6/c20-14-7-6-12(10-15(14)21)11-17(22)19-8-3-9-25-16-5-2-1-4-13(16)18(23)24/h1-2,4-7,10,20-21H,3,8-9,11H2,(H,19,22)(H,23,24)
InChIKey JNFLVOOGBDGMAX-UHFFFAOYSA-N
Molecular Weight 345.351 g/mol
SMILES OC(c1c(OCCCNC(Cc2ccc(c(c2)O)O)=O)cccc1)=O
SPLASH splash10-05fr-2930000000-b5d271a31e1bc534c5b3
Source of Spectrum KC-1988-82-24
Synonyms 2-(3-{[(3,4-dihydroxyphenyl)acetyl]amino}propoxy)benzoic acid N-[3-(2-carboxyphenoxy)propyl]-3,4-dihydroxyphenylacetamide
Wiley ID 1338624