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Methyl (2R*,3S*,5R*)-1-benzyl-3,5-bis[(4-phenyltriazol)-1-ylmethyl]pyrrolidine-2-carboxylate
SpectraBase Compound ID 3q2fAd9WXqL
InChI InChI=1S/C31H31N7O2/c1-40-31(39)30-26(19-36-21-28(32-34-36)24-13-7-3-8-14-24)17-27(38(30)18-23-11-5-2-6-12-23)20-37-22-29(33-35-37)25-15-9-4-10-16-25/h2-16,21-22,26-27,30H,17-20H2,1H3/t26-,27-,30-/m1/s1
InChIKey OKLXWOFIGAXJPU-YCVRVPNXSA-N
Mol Weight 533.64 g/mol
Molecular Formula C31H31N7O2
Exact Mass 533.253923 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2qeSzSHvwyZ
Name Methyl (2R*,3S*,5R*)-1-benzyl-3,5-bis[(4-phenyltriazol)-1-ylmethyl]pyrrolidine-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H31N7O2
InChI InChI=1S/C31H31N7O2/c1-40-31(39)30-26(19-36-21-28(32-34-36)24-13-7-3-8-14-24)17-27(38(30)18-23-11-5-2-6-12-23)20-37-22-29(33-35-37)25-15-9-4-10-16-25/h2-16,21-22,26-27,30H,17-20H2,1H3/t26-,27-,30-/m1/s1
InChIKey OKLXWOFIGAXJPU-YCVRVPNXSA-N
Molecular Weight 533.636 g/mol
SMILES [C@@]1(N([C@]([C@](C1)(C[n]1nnc(c1)-c1ccccc1)[H])(C(=O)OC)[H])Cc1ccccc1)(C[n]1nnc(c1)-c1ccccc1)[H]
SPLASH splash10-0006-9425700000-9c6d00bb083b5ef9ce82
Source of Spectrum F-66-6780-4
Wiley ID 1684355