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N-Boc-(2R,5R)-2,5-bis(5-phenylbiphenyl-3-yl)pyrrolidine

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N-Boc-(2R,5R)-2,5-bis(5-phenylbiphenyl-3-yl)pyrrolidine
SpectraBase Compound ID BNlpF8Z2SoF
InChI InChI=1S/C45H41NO2/c1-45(2,3)48-44(47)46-42(40-28-36(32-16-8-4-9-17-32)26-37(29-40)33-18-10-5-11-19-33)24-25-43(46)41-30-38(34-20-12-6-13-21-34)27-39(31-41)35-22-14-7-15-23-35/h4-23,26-31,42-43H,24-25H2,1-3H3/t42-,43-/m1/s1
InChIKey YZKAVJCMYJPWAG-OCQXTOTRSA-N
Mol Weight 627.8 g/mol
Molecular Formula C45H41NO2
Exact Mass 627.31373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8nU57a5278b
Name N-Boc-(2R,5R)-2,5-bis(5-phenylbiphenyl-3-yl)pyrrolidine
Alternate Name(s) (2R,5R)-tert-butyl 2,5-di([1,1':3',1''-terphenyl]-5'-yl)pyrrolidine-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C45H41NO2
InChI InChI=1S/C45H41NO2/c1-45(2,3)48-44(47)46-42(40-28-36(32-16-8-4-9-17-32)26-37(29-40)33-18-10-5-11-19-33)24-25-43(46)41-30-38(34-20-12-6-13-21-34)27-39(31-41)35-22-14-7-15-23-35/h4-23,26-31,42-43H,24-25H2,1-3H3/t42-,43-/m1/s1
InChIKey YZKAVJCMYJPWAG-OCQXTOTRSA-N
Literature Reference DOI 10.1021/jo502388r
Molecular Weight 627.828 g/mol
SMILES c1(cc(-c2ccccc2)cc(-c2ccccc2)c1)[C@@]1(N(C(OC(C)(C)C)=O)[C@@](c2cc(cc(c2)-c2ccccc2)-c2ccccc2)(CC1)[H])[H]
SPLASH splash10-0aba-3092430000-6dd29fd8646597db2edd
Source of Spectrum J-80-342-22h
Wiley ID 1755862