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(S)-N-(2E,7Z)-Tetradecadienyl-homoserine lactone
SpectraBase Compound ID 6NS92xXz5cv
InChI InChI=1S/C18H29NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-17(20)19-16-14-15-22-18(16)21/h7-8,12-13,16H,2-6,9-11,14-15H2,1H3,(H,19,20)/b8-7-,13-12+/t16-/m0/s1
InChIKey TYHKFWFVACFWKK-SLMRMYRXSA-N
Mol Weight 307.43 g/mol
Molecular Formula C18H29NO3
Exact Mass 307.214744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GFZBuhYAWrr
Name (S)-N-(2E,7Z)-Tetradecadienyl-homoserine lactone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H29NO3
InChI InChI=1S/C18H29NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-17(20)19-16-14-15-22-18(16)21/h7-8,12-13,16H,2-6,9-11,14-15H2,1H3,(H,19,20)/b8-7-,13-12+/t16-/m0/s1
InChIKey TYHKFWFVACFWKK-SLMRMYRXSA-N
Instrument Name Agilent 6890-HP 5973
Ionization Type EI
Literature Reference DOI 10.1021/np900043j
Molecular Weight 307.434 g/mol
Optical Rotation [a]D20 = -12.0 (c = 0.7, MeOH)
SMILES N(C(\C=C\CCC\C=C/CCCCCC)=O)[C@]1(CCOC1=O)[H]
SPLASH splash10-05nf-9700000000-c9eeddaa76a05d493b92
Source of Spectrum G4-72-SM1-6
Wiley ID 1872104