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6-[6'-Acetoxy-2'-(p-acetoxyphenyl)-3-chloro-1-ethylindol-5'-yl]hexan-1-al
SpectraBase Compound ID CCagSzOglRD
InChI InChI=1S/C26H28ClNO5/c1-4-28-23-16-24(33-18(3)31)20(9-7-5-6-8-14-29)15-22(23)25(27)26(28)19-10-12-21(13-11-19)32-17(2)30/h10-16H,4-9H2,1-3H3
InChIKey NAWVXXBLUAJXEF-UHFFFAOYSA-N
Mol Weight 469.97 g/mol
Molecular Formula C26H28ClNO5
Exact Mass 469.165601 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HGNQoFfWbjW
Name 6-[6'-Acetoxy-2'-(p-acetoxyphenyl)-3-chloro-1-ethylindol-5'-yl]hexan-1-al
Alternate Name(s) 4-[6-(acetyloxy)-3-chloro-1-ethyl-5-(6-oxohexyl)-1H-indol-2-yl]phenyl acetate
Comments Less than 3 mono-isotopic peaks
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Formula C26H28ClNO5
InChI InChI=1S/C26H28ClNO5/c1-4-28-23-16-24(33-18(3)31)20(9-7-5-6-8-14-29)15-22(23)25(27)26(28)19-10-12-21(13-11-19)32-17(2)30/h10-16H,4-9H2,1-3H3
InChIKey NAWVXXBLUAJXEF-UHFFFAOYSA-N
Molecular Weight 469.965 g/mol
SMILES c12[n](c(c(c2cc(c(c1)OC(=O)C)CCCCCC=O)Cl)-c1ccc(OC(=O)C)cc1)CC
SPLASH splash10-00or-0000900000-0bade06067ca17bcc61c
Source of Spectrum D8-327-358-33
Wiley ID 1515226