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(2S,12'SR)-1-Benzyloxycarbonyl-2-(12'-hydroxy-1'-tridecenyl)pyrrolidine
SpectraBase Compound ID 1g9JWq3hTov
InChI InChI=1S/C25H39NO3/c1-22(27)15-10-7-5-3-2-4-6-8-13-18-24-19-14-20-26(24)25(28)29-21-23-16-11-9-12-17-23/h9,11-13,16-18,22,24,27H,2-8,10,14-15,19-21H2,1H3/b18-13+/t22?,24-/m1/s1
InChIKey APMQEURELISVMN-OTOBTTTPSA-N
Mol Weight 401.6 g/mol
Molecular Formula C25H39NO3
Exact Mass 401.292994 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HXfSm24Qo4X
Name (2S,12'SR)-1-Benzyloxycarbonyl-2-(12'-hydroxy-1'-tridecenyl)pyrrolidine
Alternate Name(s) benzyl (2S)-2-[(1E)-12-hydroxy-1-tridecenyl]-1-pyrrolidinecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H39NO3
InChI InChI=1S/C25H39NO3/c1-22(27)15-10-7-5-3-2-4-6-8-13-18-24-19-14-20-26(24)25(28)29-21-23-16-11-9-12-17-23/h9,11-13,16-18,22,24,27H,2-8,10,14-15,19-21H2,1H3/b18-13+/t22?,24-/m1/s1
InChIKey APMQEURELISVMN-OTOBTTTPSA-N
Molecular Weight 401.591 g/mol
SMILES OC(CCCCCCCCC\C=C\[C@]1(N(C(OCc2ccccc2)=O)CCC1)[H])C
SPLASH splash10-0006-9220000000-d2fe03e80439e086ad57
Source of Spectrum F-52-6866-10
Wiley ID 796493