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2-Pyrrolidineethanol, 1-methyl-.alpha.-(4-phenyl-1,3-butadienyl)-, [R*,S*-(E,Z)]-(+)-
SpectraBase Compound ID sIlX229imd
InChI InChI=1S/C17H23NO/c1-18-13-7-11-16(18)14-17(19)12-6-5-10-15-8-3-2-4-9-15/h2-6,8-10,12,16-17,19H,7,11,13-14H2,1H3/b10-5-,12-6+/t16-,17-/m0/s1
InChIKey NTGQEIWCKMMRRN-DLXLEBDZSA-N
Mol Weight 257.38 g/mol
Molecular Formula C17H23NO
Exact Mass 257.177964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID OvZjYwVB8B
Name 2-Pyrrolidineethanol, 1-methyl-.alpha.-(4-phenyl-1,3-butadienyl)-, [R*,S*-(E,Z)]-(+)-
CAS Registry Number 73069-58-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H23NO
InChI InChI=1S/C17H23NO/c1-18-13-7-11-16(18)14-17(19)12-6-5-10-15-8-3-2-4-9-15/h2-6,8-10,12,16-17,19H,7,11,13-14H2,1H3/b10-5-,12-6+/t16-,17-/m0/s1
InChIKey NTGQEIWCKMMRRN-DLXLEBDZSA-N
Molecular Weight 257.377 g/mol
SMILES O[C@@](\C=C\C=C/c1ccccc1)(C[C@]1(N(CCC1)C)[H])[H]
SPLASH splash10-001i-9000000000-122aacb1dd5f827ffba9
Source of Spectrum B-32-2530-0
Synonyms (2R,3E,5Z)-1-[(2S)-1-methylpyrrolidinyl]-6-phenyl-3,5-hexadien-2-ol Isodarlingianine
Wiley ID 1261012