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N-[(1S,5S)-5-[acetyl-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]amino]-1-allyl-oct-7-enyl]-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]acetamide
SpectraBase Compound ID LbRlqB3yYmR
InChI InChI=1S/C27H48N4O4/c1-7-12-24(30(22(3)32)28-18-10-16-26(28)20-34-5)14-9-15-25(13-8-2)31(23(4)33)29-19-11-17-27(29)21-35-6/h7-8,24-27H,1-2,9-21H2,3-6H3/t24-,25-,26+,27+/m1/s1
InChIKey PXOFVPJMTMBZQV-XDZXDJIYSA-N
Mol Weight 492.7 g/mol
Molecular Formula C27H48N4O4
Exact Mass 492.367556 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IQlABvntkiJ
Name N-[(1S,5S)-5-[acetyl-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]amino]-1-allyl-oct-7-enyl]-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H48N4O4
InChI InChI=1S/C27H48N4O4/c1-7-12-24(30(22(3)32)28-18-10-16-26(28)20-34-5)14-9-15-25(13-8-2)31(23(4)33)29-19-11-17-27(29)21-35-6/h7-8,24-27H,1-2,9-21H2,3-6H3/t24-,25-,26+,27+/m1/s1
InChIKey PXOFVPJMTMBZQV-XDZXDJIYSA-N
Molecular Weight 492.705 g/mol
SMILES C(N(N1[C@](COC)(CCC1)[H])[C@](CC=C)(CCC[C@](N(N1[C@](COC)(CCC1)[H])C(=O)C)(CC=C)[H])[H])(=O)C
SPLASH splash10-01ot-3900400000-60ac7d137c4283036f33
Source of Spectrum CV-2002-2551-3
Synonyms N-[(1S,5S)-5-[acetyl-[(2S)-2-(methoxymethyl)pyrrolidino]amino]-1-allyl-oct-7-enyl]-N-[(2S)-2-(methoxymethyl)pyrrolidino]acetamide N-[(4S,8S)-8-[acetyl-[(2S)-2-(methoxymethyl)-1-pyrrolidinyl]amino]undeca-1,10-dien-4-yl]-N-[(2S)-2-(methoxymethyl)-1-pyrrolidinyl]acetamide N-[(4S,8S)-8-[acetyl-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]amino]undeca-1,10-dien-4-yl]-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]acetamide N-[(4S,8S)-8-[ethanoyl-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]amino]undeca-1,10-dien-4-yl]-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]ethanamide
Wiley ID 1610542