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(1R,4R,5S)-2-bromo-N-(4-methoxybenzyl)-4,5-bis(methoxymethoxy)cyclohex-2-enamine
SpectraBase Compound ID GMHerS7s9lx
InChI InChI=1S/C18H26BrNO5/c1-21-11-24-17-8-15(19)16(9-18(17)25-12-22-2)20-10-13-4-6-14(23-3)7-5-13/h4-8,16-18,20H,9-12H2,1-3H3/t16-,17-,18+/m1/s1
InChIKey PBLJXQZHZHMPPE-KURKYZTESA-N
Mol Weight 416.31 g/mol
Molecular Formula C18H26BrNO5
Exact Mass 415.099436 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID jTPBPxUBhX
Name (1R,4R,5S)-2-bromo-N-(4-methoxybenzyl)-4,5-bis(methoxymethoxy)cyclohex-2-enamine
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Formula C18H26BrNO5
InChI InChI=1S/C18H26BrNO5/c1-21-11-24-17-8-15(19)16(9-18(17)25-12-22-2)20-10-13-4-6-14(23-3)7-5-13/h4-8,16-18,20H,9-12H2,1-3H3/t16-,17-,18+/m1/s1
InChIKey PBLJXQZHZHMPPE-KURKYZTESA-N
Literature Reference DOI 10.1021/ol071344y
Molecular Weight 416.312 g/mol
SMILES N(Cc1ccc(cc1)OC)[C@]1(C(=C[C@@](OCOC)([C@@](OCOC)(C1)[H])[H])Br)[H]
SPLASH splash10-00dr-5932100000-dda4da9c56ae77b7c3ce
Source of Spectrum A1-9-3503/SMS17-14a
Wiley ID 1758435