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N-(2-Bromo-2-propenyl)-2.beta.-carbomethoxy-3.beta.-(4'-iodophenyl)nortropane
SpectraBase Compound ID Je39SUD1cx2
InChI InChI=1S/C18H21BrINO2/c1-11(19)10-21-14-7-8-16(21)17(18(22)23-2)15(9-14)12-3-5-13(20)6-4-12/h3-6,14-17H,1,7-10H2,2H3/t14-,15-,16+,17-/m1/s1
InChIKey DLPVJOABBWHGLU-WCXIOVBPSA-N
Mol Weight 490.18 g/mol
Molecular Formula C18H21BrINO2
Exact Mass 488.980037 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9nZG5biPgnJ
Name N-(2-Bromo-2-propenyl)-2.beta.-carbomethoxy-3.beta.-(4'-iodophenyl)nortropane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21BrINO2
InChI InChI=1S/C18H21BrINO2/c1-11(19)10-21-14-7-8-16(21)17(18(22)23-2)15(9-14)12-3-5-13(20)6-4-12/h3-6,14-17H,1,7-10H2,2H3/t14-,15-,16+,17-/m1/s1
InChIKey DLPVJOABBWHGLU-WCXIOVBPSA-N
Molecular Weight 490.179 g/mol
SMILES [C@@]12(N([C@@](C[C@@]([C@]2(C(=O)OC)[H])(c2ccc(cc2)I)[H])(CC1)[H])CC(=C)Br)[H]
SPLASH splash10-03ki-0900500000-89a182d6e80b90701339
Source of Spectrum E1-40-1370-5
Wiley ID 1599228