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(1S,2R,5S)-Menthyl r-2S-methoxycarbonyl-2-phenyl-c-5S-(2'-iodoquinolin-3'-yl)pyrrolidine-c-4R-carboxuylate
SpectraBase Compound ID 1ZtTaAQyWpg
InChI InChI=1S/C32H37IN2O4/c1-19(2)23-15-14-20(3)16-27(23)39-30(36)25-18-32(31(37)38-4,22-11-6-5-7-12-22)35-28(25)24-17-21-10-8-9-13-26(21)34-29(24)33/h5-13,17,19-20,23,25,27-28,35H,14-16,18H2,1-4H3/t20-,23+,25-,27-,28+,32-/m0/s1
InChIKey YJOJLUXLHZQCLU-KIWJFWLLSA-N
Mol Weight 640.6 g/mol
Molecular Formula C32H37IN2O4
Exact Mass 640.179803 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G0mNXQUnMkF
Name (1S,2R,5S)-Menthyl r-2S-methoxycarbonyl-2-phenyl-c-5S-(2'-iodoquinolin-3'-yl)pyrrolidine-c-4R-carboxuylate
Alternate Name(s) (1S,2R,5S)-Menthyl r-2S-methoxycarbonyl-2-phenyl-c-5S-(2'-iodoquinolin-3'-yl)pyrrolidine-c-4R-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H37IN2O4
InChI InChI=1S/C32H37IN2O4/c1-19(2)23-15-14-20(3)16-27(23)39-30(36)25-18-32(31(37)38-4,22-11-6-5-7-12-22)35-28(25)24-17-21-10-8-9-13-26(21)34-29(24)33/h5-13,17,19-20,23,25,27-28,35H,14-16,18H2,1-4H3/t20-,23+,25-,27-,28+,32-/m0/s1
InChIKey YJOJLUXLHZQCLU-KIWJFWLLSA-N
Molecular Weight 640.562 g/mol
SMILES N1[C@@]([C@](C[C@@]1(C(=O)OC)c1ccccc1)(C(O[C@@]1([C@](CC[C@@](C1)(C)[H])(C(C)C)[H])[H])=O)[H])(c1c(nc2c(c1)cccc2)I)[H]
SPLASH splash10-001l-0032494000-01218473f66c3250b822
Source of Spectrum F-51-301-11
Wiley ID 790371