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(trans)-N-Methyl-2-(2'-propen-1'-yl)-5-(pent-2"-en-4"-yn-1"-yl)-decahydroquinoline

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(trans)-N-Methyl-2-(2'-propen-1'-yl)-5-(pent-2"-en-4"-yn-1"-yl)-decahydroquinoline
SpectraBase Compound ID 2Km5bVhfELL
InChI InChI=1S/C18H27N/c1-4-6-7-10-15-11-8-12-18-17(15)14-13-16(9-5-2)19(18)3/h1,5-7,15-18H,2,8-14H2,3H3/b7-6-/t15-,16-,17?,18-/m0/s1
InChIKey LXIAVCSTDIHYBS-OAZADAQTSA-N
Mol Weight 257.42 g/mol
Molecular Formula C18H27N
Exact Mass 257.21435 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Iw2AYWDqm4f
Name (Trans)-N-methyl-2-(2'-propen-1'-yl)-5-(pent-2""""-en-4""""-yn-1""""-yl)-decahydroquinoline
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 257.214349873 u
Formula C18H27N
InChI InChI=1S/C18H27N/c1-4-6-7-10-15-11-8-12-18-17(15)14-13-16(9-5-2)19(18)3/h1,5-7,15-18H,2,8-14H2,3H3/b7-6-/t15-,16-,17?,18-/m0/s1
InChIKey LXIAVCSTDIHYBS-OAZADAQTSA-N
Molecular Weight 257.421 g/mol
SMILES [C@@]12(N([C@](CCC2[C@@](C\C=C/C#C)(CCC1)[H])(CC=C)[H])C)[H]