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(S)-N,N'-Bis-[2-hydroxy-1-(hydroxymethyl)ethyl]-5-[(2-hydroxy-1-oxypropyl)amino]-1,3-benzenedicarboxamide
SpectraBase Compound ID 6IsdDpbMTe0
InChI InChI=1S/C17H25N3O8/c1-9(25)15(26)18-12-3-10(16(27)19-13(5-21)6-22)2-11(4-12)17(28)20-14(7-23)8-24/h2-4,9,13-14,21-25H,5-8H2,1H3,(H,18,26)(H,19,27)(H,20,28)
InChIKey LXQXAPIYJMQBQY-UHFFFAOYSA-N
Mol Weight 399.4 g/mol
Molecular Formula C17H25N3O8
Exact Mass 399.164165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Gw6sAWFDVd
Name (S)-N,N'-Bis-[2-hydroxy-1-(hydroxymethyl)ethyl]-5-[(2-hydroxy-1-oxypropyl)amino]-1,3-benzenedicarboxamide
CAS Registry Number 81126-71-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H25N3O8
InChI InChI=1S/C17H25N3O8/c1-9(25)15(26)18-12-3-10(16(27)19-13(5-21)6-22)2-11(4-12)17(28)20-14(7-23)8-24/h2-4,9,13-14,21-25H,5-8H2,1H3,(H,18,26)(H,19,27)(H,20,28)
InChIKey LXQXAPIYJMQBQY-UHFFFAOYSA-N
Molecular Weight 399.400 g/mol
SMILES N(c1cc(cc(C(NC(CO)CO)=O)c1)C(NC(CO)CO)=O)C(C(C)O)=O
SPLASH splash10-001i-0679000000-73b043be6b7a174d4a0a
Source of Spectrum KO-9-258-1
Synonyms 1-N,3-N-bis(1,3-dihydroxypropan-2-yl)-5-(2-hydroxypropanoylamino)benzene-1,3-dicarboxamide N,N'-bis(2-hydroxy-1-methylol-ethyl)-5-lactamido-isophthalamide N1,N3-bis(1,3-dihydroxypropan-2-yl)-5-[(2-hydroxy-1-oxopropyl)amino]benzene-1,3-dicarboxamide N1,N3-bis[1,3-bis(oxidanyl)propan-2-yl]-5-(2-oxidanylpropanoylamino)benzene-1,3-dicarboxamide N1,N3-bis[2-hydroxy-1-(hydroxymethyl)ethyl]-5-(2-hydroxypropanoylamino)benzene-1,3-dicarboxamide
Wiley ID 1368882