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(3S,4S,5S,7aR)-(-)-3,5-Diphenyl-4-benzylpyrrolizidinium chloride
SpectraBase Compound ID 6MWJU4JMyz8
InChI InChI=1S/C26H28N.ClH/c1-4-10-21(11-5-1)20-27-24(16-18-25(27)22-12-6-2-7-13-22)17-19-26(27)23-14-8-3-9-15-23;/h1-15,24-26H,16-20H2;1H/q+1;/p-1/t24?,25-,26-,27?;/m0./s1
InChIKey UYAPNLJFPOXZNW-CZXXIYROSA-M
Mol Weight 389.97 g/mol
Molecular Formula C26H28ClN
Exact Mass 389.191028 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Uj4bn9LW0r
Name (3S,4S,5S,7aR)-(-)-3,5-Diphenyl-4-benzylpyrrolizidinium chloride
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H28ClN
InChI InChI=1S/C26H28N.ClH/c1-4-10-21(11-5-1)20-27-24(16-18-25(27)22-12-6-2-7-13-22)17-19-26(27)23-14-8-3-9-15-23;/h1-15,24-26H,16-20H2;1H/q+1;/p-1/t24?,25-,26-,27?;/m0./s1
InChIKey UYAPNLJFPOXZNW-CZXXIYROSA-M
Molecular Weight 389.970 g/mol
SMILES [Cl-].[C@]1([N+]2(C(CC1)CC[C@]2(c1ccccc1)[H])Cc1ccccc1)(c1ccccc1)[H]
SPLASH splash10-0006-9000000000-a88e2e08c16096c144f6
Source of Spectrum J-64-1731-6
Synonyms (3S,5S)-4-benzyl-3,5-diphenyl-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium;chloride (3S,5S)-3,5-diphenyl-4-(phenylmethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium;chloride
Wiley ID 1529567