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3-(Benzo-15-crown-5)prop-2-en-1-al

View entire compound with spectra: 1 NMR, and 1 MS (GC)

3-(Benzo-15-crown-5)prop-2-en-1-al
SpectraBase Compound ID wadD4yBM29
InChI InChI=1S/C17H22O6/c18-5-1-2-15-3-4-16-17(14-15)23-13-11-21-9-7-19-6-8-20-10-12-22-16/h1-5,14H,6-13H2/b2-1+
InChIKey GJXZPZNFFDZSJZ-OWOJBTEDSA-N
Mol Weight 322.36 g/mol
Molecular Formula C17H22O6
Exact Mass 322.141638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HMwEZriggYS
Name 3-(Benzo-15-crown-5)prop-2-en-1-al
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22O6
InChI InChI=1S/C17H22O6/c18-5-1-2-15-3-4-16-17(14-15)23-13-11-21-9-7-19-6-8-20-10-12-22-16/h1-5,14H,6-13H2/b2-1+
InChIKey GJXZPZNFFDZSJZ-OWOJBTEDSA-N
Molecular Weight 322.357 g/mol
SMILES c12c(OCCOCCOCCOCCO2)ccc(\C=C\C=O)c1
SPLASH splash10-0buc-0900000000-92f98da6caa3794932ec
Source of Spectrum SO-0-891-3
Synonyms (E)-3-(2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-17-yl)-2-propenal (E)-3-(2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-17-yl)prop-2-enal
Wiley ID 863838