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3-[4'-(4",7",10",13",16"-Pentaoxa-1"-azacyclooctadecyl)phenyl]propen-2-al
SpectraBase Compound ID 7uSNn28ADit
InChI InChI=1S/C21H31NO6/c23-9-1-2-20-3-5-21(6-4-20)22-7-10-24-12-14-26-16-18-28-19-17-27-15-13-25-11-8-22/h1-6,9H,7-8,10-19H2/b2-1+
InChIKey LZMOADXFDFGDAU-OWOJBTEDSA-N
Mol Weight 393.48 g/mol
Molecular Formula C21H31NO6
Exact Mass 393.215138 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kssnium5pSF
Name 3-[4'-(4",7",10",13",16"-Pentaoxa-1"-azacyclooctadecyl)phenyl]propen-2-al
Alternate Name(s) (2E)-3-[4-(1,4,7,10,13-pentaoxa-16-azacyclooctadecan-16-yl)phenyl]-2-propenal 3-[4'-(4'',7'',10'',13'',16''-Pentaoxa-1''-azacyclooctadecyl)phenyl]propen-2-al
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Formula C21H31NO6
InChI InChI=1S/C21H31NO6/c23-9-1-2-20-3-5-21(6-4-20)22-7-10-24-12-14-26-16-18-28-19-17-27-15-13-25-11-8-22/h1-6,9H,7-8,10-19H2/b2-1+
InChIKey LZMOADXFDFGDAU-OWOJBTEDSA-N
Molecular Weight 393.480 g/mol
SMILES c1(N2CCOCCOCCOCCOCCOCC2)ccc(\C=C\C=O)cc1
SPLASH splash10-0006-2529000000-624cf8339bc34b6ab7f6
Source of Spectrum QF-48-536-6
Wiley ID 834027