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(S)-4-[N-(tert-Butoxycarbonyl)-N-(2-iodobenzyl)amino]pent-2-ene
SpectraBase Compound ID HDtQ56BMLEA
InChI InChI=1S/C17H24INO2/c1-6-9-13(2)19(16(20)21-17(3,4)5)12-14-10-7-8-11-15(14)18/h6-11,13H,12H2,1-5H3/b9-6+/t13-/m0/s1
InChIKey BDJWKYQRAMNHHT-PPGNKHEKSA-N
Mol Weight 401.29 g/mol
Molecular Formula C17H24INO2
Exact Mass 401.085174 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GgkYRvN27mc
Name (S)-4-[N-(tert-Butoxycarbonyl)-N-(2-iodobenzyl)amino]pent-2-ene
Alternate Name(s) tert-Butyl 2-iodobenzyl[(1S,2E)-1-methyl-2-butenyl]carbamate
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Formula C17H24INO2
InChI InChI=1S/C17H24INO2/c1-6-9-13(2)19(16(20)21-17(3,4)5)12-14-10-7-8-11-15(14)18/h6-11,13H,12H2,1-5H3/b9-6+/t13-/m0/s1
InChIKey BDJWKYQRAMNHHT-PPGNKHEKSA-N
Molecular Weight 401.288 g/mol
SMILES C(N(Cc1c(I)cccc1)[C@](\C=C\C)(C)[H])(OC(C)(C)C)=O
SPLASH splash10-0a4l-9010000000-0e2b865495c398c86f23
Source of Spectrum SO-0-1333-3
Wiley ID 1545341