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(E)-[(Z)-12-[(2R)-1-benzylpyrrolidin-2-yl]dodec-11-enylidene]-[(2S)-2-(methoxymethyl)pyrrolidino]amine
SpectraBase Compound ID 5TjPoX95cgl
InChI InChI=1S/C29H47N3O/c1-33-26-29-21-16-24-32(29)30-22-14-9-7-5-3-2-4-6-8-13-19-28-20-15-23-31(28)25-27-17-11-10-12-18-27/h10-13,17-19,22,28-29H,2-9,14-16,20-21,23-26H2,1H3/b19-13-,30-22+/t28-,29-/m0/s1
InChIKey YFVPSSAPFIZITD-JCQHEECCSA-N
Mol Weight 453.7 g/mol
Molecular Formula C29H47N3O
Exact Mass 453.371913 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Go72VlRC3n
Name (E)-[(Z)-12-[(2R)-1-benzylpyrrolidin-2-yl]dodec-11-enylidene]-[(2S)-2-(methoxymethyl)pyrrolidino]amine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H47N3O
InChI InChI=1S/C29H47N3O/c1-33-26-29-21-16-24-32(29)30-22-14-9-7-5-3-2-4-6-8-13-19-28-20-15-23-31(28)25-27-17-11-10-12-18-27/h10-13,17-19,22,28-29H,2-9,14-16,20-21,23-26H2,1H3/b19-13-,30-22+/t28-,29-/m0/s1
InChIKey YFVPSSAPFIZITD-JCQHEECCSA-N
Molecular Weight 453.715 g/mol
SMILES C(N1[C@@](\C=C/CCCCCCCCC\C=N\N2[C@](COC)(CCC2)[H])(CCC1)[H])c1ccccc1
SPLASH splash10-000f-9304000000-597eb57f8bc3d99712ac
Source of Spectrum SO-0-511-6
Synonyms (E,Z)-N-[(2S)-2-(methoxymethyl)-1-pyrrolidinyl]-12-[(2R)-1-(phenylmethyl)-2-pyrrolidinyl]-11-dodecen-1-imine (E,Z)-12-[(2R)-1-benzylpyrrolidin-2-yl]-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]dodec-11-en-1-imine
Wiley ID 877590