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2,2,2-trichloro-N-[(E,1S)-1-[(3,6,7-trimethoxy-9-phenanthryl)methyl]but-2-enyl]acetamide
SpectraBase Compound ID C99hVNb9Rxx
InChI InChI=1S/C24H24Cl3NO4/c1-5-6-16(28-23(29)24(25,26)27)10-15-9-14-7-8-17(30-2)11-18(14)20-13-22(32-4)21(31-3)12-19(15)20/h5-9,11-13,16H,10H2,1-4H3,(H,28,29)/b6-5+/t16-/m1/s1
InChIKey BCEOFIHLZZZVLB-SQRWCISFSA-N
Mol Weight 496.82 g/mol
Molecular Formula C24H24Cl3NO4
Exact Mass 495.077091 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BwX9bP4yn63
Name 2,2,2-trichloro-N-[(E,1S)-1-[(3,6,7-trimethoxy-9-phenanthryl)methyl]but-2-enyl]acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H24Cl3NO4
InChI InChI=1S/C24H24Cl3NO4/c1-5-6-16(28-23(29)24(25,26)27)10-15-9-14-7-8-17(30-2)11-18(14)20-13-22(32-4)21(31-3)12-19(15)20/h5-9,11-13,16H,10H2,1-4H3,(H,28,29)/b6-5+/t16-/m1/s1
InChIKey BCEOFIHLZZZVLB-SQRWCISFSA-N
Molecular Weight 496.818 g/mol
SMILES N(C(C(Cl)(Cl)Cl)=O)[C@@](Cc1c2c(c3c(c1)ccc(c3)OC)cc(c(OC)c2)OC)(\C=C\C)[H]
SPLASH splash10-001i-0090000000-64e721805a08010397cd
Source of Spectrum F-69-3147-12
Synonyms 2,2,2-trichloro-N-[(E,2S)-1-(3,6,7-trimethoxy-9-phenanthrenyl)pent-3-en-2-yl]acetamide 2,2,2-trichloro-N-[(E,2S)-1-(3,6,7-trimethoxyphenanthren-9-yl)pent-3-en-2-yl]acetamide 2,2,2-tris(chloranyl)-N-[(E,2S)-1-(3,6,7-trimethoxyphenanthren-9-yl)pent-3-en-2-yl]ethanamide
Wiley ID 1594952