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(E/Z)-2-(2-phthalimodophenyl)but-2-ene-1,4-diol
SpectraBase Compound ID CwuVv8LVlsz
InChI InChI=1S/C18H15NO4/c20-9-8-11(10-21)12-4-1-2-5-13(12)14-6-3-7-15-16(14)18(23)19-17(15)22/h1-8,20-21H,9-10H2,(H,19,22,23)/b11-8-
InChIKey JKRLNJFLCBHKFY-FLIBITNWSA-N
Mol Weight 309.32 g/mol
Molecular Formula C18H15NO4
Exact Mass 309.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5s3hvKwpXmh
Name (E/Z)-2-(2-phthalimodophenyl)but-2-ene-1,4-diol
Alternate Name(s) 4-{2-[(1E)-3-hydroxy-1-(hydroxymethyl)-1-propenyl]phenyl}-1H-isoindole-1,3(2H)-dione
CAS Registry Number 113290-63-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H15NO4
InChI InChI=1S/C18H15NO4/c20-9-8-11(10-21)12-4-1-2-5-13(12)14-6-3-7-15-16(14)18(23)19-17(15)22/h1-8,20-21H,9-10H2,(H,19,22,23)/b11-8-
InChIKey JKRLNJFLCBHKFY-FLIBITNWSA-N
Molecular Weight 309.321 g/mol
SMILES N1C(c2c(c(-c3c(\C(CO)=C\CO)cccc3)ccc2)C1=O)=O
SPLASH splash10-03ec-0490000000-1d0799bd83fac03cdc83
Source of Spectrum KC-1987-1544-21
Wiley ID 1310693