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Pyrrolidine, 1-benzoyl-2,5-bis[4-(phenylmethoxy)butyl]-, (2R-trans)-
SpectraBase Compound ID LOI1DFdsHBL
InChI InChI=1S/C33H41NO3/c35-33(30-18-8-3-9-19-30)34-31(20-10-12-24-36-26-28-14-4-1-5-15-28)22-23-32(34)21-11-13-25-37-27-29-16-6-2-7-17-29/h1-9,14-19,31-32H,10-13,20-27H2/t31-,32-/m1/s1
InChIKey WVMLJLQXLWXFGR-ROJLCIKYSA-N
Mol Weight 499.7 g/mol
Molecular Formula C33H41NO3
Exact Mass 499.308644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BRMX4Vs6Xxi
Name Pyrrolidine, 1-benzoyl-2,5-bis[4-(phenylmethoxy)butyl]-, (2R-trans)-
Alternate Name(s) (2R,5R)-1-benzoyl-2,5-bis[4-(benzyloxy)butyl]pyrrolidine (2R,5R)-N-benzoyl-2,5-bis[4-(benzyloxy)butyl]-pyrrolidine
CAS Registry Number 131618-37-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H41NO3
InChI InChI=1S/C33H41NO3/c35-33(30-18-8-3-9-19-30)34-31(20-10-12-24-36-26-28-14-4-1-5-15-28)22-23-32(34)21-11-13-25-37-27-29-16-6-2-7-17-29/h1-9,14-19,31-32H,10-13,20-27H2/t31-,32-/m1/s1
InChIKey WVMLJLQXLWXFGR-ROJLCIKYSA-N
Molecular Weight 499.695 g/mol
SMILES C(N1[C@@](CC[C@]1(CCCCOCc1ccccc1)[H])(CCCCOCc1ccccc1)[H])(=O)c1ccccc1
SPLASH splash10-0a4j-0901000000-e1782aca762a8b344650
Source of Spectrum J-56-1390-14
Wiley ID 1398751