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Ethyl (E)-3-[(Z)-1-(Butylimino)-3-hexyl-6,7-dimethoxy-1H-isochromen-4-yl]acrylate
SpectraBase Compound ID HC8uaUOWo2h
InChI InChI=1S/C26H37NO5/c1-6-9-11-12-13-22-19(14-15-25(28)31-8-3)20-17-23(29-4)24(30-5)18-21(20)26(32-22)27-16-10-7-2/h14-15,17-18H,6-13,16H2,1-5H3/b15-14+,27-26-
InChIKey MTEKPJPGYHTBTG-ITULNCLISA-N
Mol Weight 443.6 g/mol
Molecular Formula C26H37NO5
Exact Mass 443.267173 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6and80fxKNf
Name Ethyl (E)-3-[(Z)-1-(Butylimino)-3-hexyl-6,7-dimethoxy-1H-isochromen-4-yl]acrylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H37NO5
InChI InChI=1S/C26H37NO5/c1-6-9-11-12-13-22-19(14-15-25(28)31-8-3)20-17-23(29-4)24(30-5)18-21(20)26(32-22)27-16-10-7-2/h14-15,17-18H,6-13,16H2,1-5H3/b15-14+,27-26-
InChIKey MTEKPJPGYHTBTG-ITULNCLISA-N
Molecular Weight 443.584 g/mol
SMILES c12C(=C(CCCCCC)O\C(c2cc(c(c1)OC)OC)=N\CCCC)\C=C\C(=O)OCC
SPLASH splash10-0a4i-5901100000-648991f0608e63d54a57
Source of Spectrum Y-45-2105-9k
Synonyms (E)-ethyl 3-((Z)-1-(butylimino)-3-hexyl-6,7-dimethoxy-1H-isochromen-4-yl)acrylate
Wiley ID 1737084