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(5Z,9Z,12Z)-1-pyrrolidin-1-yloctadeca-5,9,12-trien-1-one
SpectraBase Compound ID JE34KHooC7d
InChI InChI=1S/C22H37NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22(24)23-20-17-18-21-23/h6-7,9-10,13-14H,2-5,8,11-12,15-21H2,1H3/b7-6-,10-9-,14-13-
InChIKey BHMRLSLEXOCXCC-URPRIDOGSA-N
Mol Weight 331.5 g/mol
Molecular Formula C22H37NO
Exact Mass 331.287515 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID R5hdZgHhVy
Name (5Z,9Z,12Z)-1-pyrrolidin-1-yloctadeca-5,9,12-trien-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H37NO
InChI InChI=1S/C22H37NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22(24)23-20-17-18-21-23/h6-7,9-10,13-14H,2-5,8,11-12,15-21H2,1H3/b7-6-,10-9-,14-13-
InChIKey BHMRLSLEXOCXCC-URPRIDOGSA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 331.544 g/mol
SMILES C(\C=C/CCCC(N1CCCC1)=O)C\C=C/C\C=C/CCCCC
SPLASH splash10-03e9-4900000000-7d1dfd623f87d37e3c30
Source of Spectrum US7928294B2
Wiley ID 1870456