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(2R,6R,7S,8S)-7-(but-3-en-1-yl)-2-(Pent-4-en-1-yl)-1-azaspiro[5.5]undecan-8-yl acetate
SpectraBase Compound ID 2Ifmu9NbORy
InChI InChI=1S/C21H35NO2/c1-4-6-8-11-18-12-9-15-21(22-18)16-10-14-20(24-17(3)23)19(21)13-7-5-2/h4-5,18-20,22H,1-2,6-16H2,3H3/t18?,19-,20+,21-/m1/s1
InChIKey OFYQZRCEJDPBQE-OTYNDTSQSA-N
Mol Weight 333.5 g/mol
Molecular Formula C21H35NO2
Exact Mass 333.266779 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CNrq9KiqcUj
Name (2R,6R,7S,8S)-7-(but-3-en-1-yl)-2-(Pent-4-en-1-yl)-1-azaspiro[5.5]undecan-8-yl acetate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 333.266779369 u
Formula C21H35NO2
InChI InChI=1S/C21H35NO2/c1-4-6-8-11-18-12-9-15-21(22-18)16-10-14-20(24-17(3)23)19(21)13-7-5-2/h4-5,18-20,22H,1-2,6-16H2,3H3/t18?,19-,20+,21-/m1/s1
InChIKey OFYQZRCEJDPBQE-OTYNDTSQSA-N
Molecular Weight 333.516 g/mol
SMILES C1CC[C@@]2(NC1CCCC=C)CCC[C@@]([C@]2(CCC=C)[H])(OC(=O)C)[H]