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(2R)-1-oxidanidyl-2-(phenoxymethyl)-5-[(5E,7E)-tetradeca-5,7-dienyl]-3,4-dihydro-2H-pyrrol-1-ium
SpectraBase Compound ID 67N7NXM60Zx
InChI InChI=1S/C25H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-14-17-23-20-21-24(26(23)27)22-28-25-18-15-13-16-19-25/h7-10,13,15-16,18-19,24H,2-6,11-12,14,17,20-22H2,1H3/b8-7+,10-9+/t24-/m1/s1
InChIKey FMGUPRAPGYFPQW-YHSAFHJHSA-N
Mol Weight 383.6 g/mol
Molecular Formula C25H37NO2
Exact Mass 383.282429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ehi7ur6IDJR
Name (2R)-1-oxidanidyl-2-(phenoxymethyl)-5-[(5E,7E)-tetradeca-5,7-dienyl]-3,4-dihydro-2H-pyrrol-1-ium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H37NO2
InChI InChI=1S/C25H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-14-17-23-20-21-24(26(23)27)22-28-25-18-15-13-16-19-25/h7-10,13,15-16,18-19,24H,2-6,11-12,14,17,20-22H2,1H3/b8-7+,10-9+/t24-/m1/s1
InChIKey FMGUPRAPGYFPQW-YHSAFHJHSA-N
Molecular Weight 383.576 g/mol
SMILES [C@@]1([N+](=C(CC1)CCCC\C=C\C=C\CCCCCC)[O-])(COc1ccccc1)[H]
SPLASH splash10-002f-9080000000-0d3c67de0eb8b35a0e9b
Source of Spectrum J-64-4871-40
Synonyms (2R)-1-oxido-2-(phenoxymethyl)-5-[(5E,7E)-tetradeca-5,7-dienyl]-1-pyrrolin-1-ium (2R)-1-oxido-2-(phenoxymethyl)-5-[(5E,7E)-tetradeca-5,7-dienyl]-3,4-dihydro-2H-pyrrol-1-ium
Wiley ID 1530564