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(2S,3S,5S)-2-(Phenylmethyl)-1-carbomethoxy-5-[(Z)-nonen-1-yl]-3-pyrrolidinol

View entire compound with spectra: 1 MS (GC)

(2S,3S,5S)-2-(Phenylmethyl)-1-carbomethoxy-5-[(Z)-nonen-1-yl]-3-pyrrolidinol
SpectraBase Compound ID 2A0U6VwR4f5
InChI InChI=1S/C22H33NO3/c1-3-4-5-6-7-8-12-15-19-17-21(24)20(23(19)22(25)26-2)16-18-13-10-9-11-14-18/h9-15,19-21,24H,3-8,16-17H2,1-2H3/b15-12-/t19-,20+,21+/m1/s1
InChIKey RDFXFZHVTSQPOY-ZEHHZDTHSA-N
Mol Weight 359.5 g/mol
Molecular Formula C22H33NO3
Exact Mass 359.246044 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jzc2IudJVEJ
Name (2S,3S,5S)-2-(Phenylmethyl)-1-carbomethoxy-5-[(Z)-nonen-1-yl]-3-pyrrolidinol
Alternate Name(s) methyl (2S,3S,5S)-2-benzyl-3-hydroxy-5-[(1Z)-1-nonenyl]-1-pyrrolidinecarboxylate
CAS Registry Number 131013-28-0
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H33NO3
InChI InChI=1S/C22H33NO3/c1-3-4-5-6-7-8-12-15-19-17-21(24)20(23(19)22(25)26-2)16-18-13-10-9-11-14-18/h9-15,19-21,24H,3-8,16-17H2,1-2H3/b15-12-/t19-,20+,21+/m1/s1
InChIKey RDFXFZHVTSQPOY-ZEHHZDTHSA-N
Molecular Weight 359.510 g/mol
SMILES O[C@@]1([C@@](N([C@@](C1)(\C=C/CCCCCCC)[H])C(=O)OC)(Cc1ccccc1)[H])[H]
SPLASH splash10-014i-0090000000-163fccf3aafd7e42a0d3
Source of Spectrum J-56-1132-10
Wiley ID 1347873