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N-(t-Butoxycarbonyl)-2-iodo-N-(1'-benzyl-2'-butenyl)benzamide
SpectraBase Compound ID 5BlKjeCPsPl
InChI InChI=1S/C23H26INO3/c1-5-11-18(16-17-12-7-6-8-13-17)25(22(27)28-23(2,3)4)21(26)19-14-9-10-15-20(19)24/h5-15,18H,16H2,1-4H3/b11-5+
InChIKey FHMPNVCNPWUAKN-VZUCSPMQSA-N
Mol Weight 491.37 g/mol
Molecular Formula C23H26INO3
Exact Mass 491.095739 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AJASxmBDuk7
Name N-(t-Butoxycarbonyl)-2-iodo-N-(1'-benzyl-2'-butenyl)benzamide
Alternate Name(s) tert-Butyl (2E)-1-benzyl-2-butenyl(2-iodobenzoyl)carbamate
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Formula C23H26INO3
InChI InChI=1S/C23H26INO3/c1-5-11-18(16-17-12-7-6-8-13-17)25(22(27)28-23(2,3)4)21(26)19-14-9-10-15-20(19)24/h5-15,18H,16H2,1-4H3/b11-5+
InChIKey FHMPNVCNPWUAKN-VZUCSPMQSA-N
Molecular Weight 491.369 g/mol
SMILES C(N(C(OC(C)(C)C)=O)C(\C=C\C)Cc1ccccc1)(c1c(I)cccc1)=O
SPLASH splash10-0ue9-2098300000-edff79e13997b353808d
Source of Spectrum U-1995-1155-2
Wiley ID 767157