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4,8-Tetradecadienal, 12-bromo-13-hydroxy-5,9,13-trimethyl-, (E,E)-(.+-.)-

View entire compound with spectra: 1 MS (GC)

4,8-Tetradecadienal, 12-bromo-13-hydroxy-5,9,13-trimethyl-, (E,E)-(.+-.)-
SpectraBase Compound ID 8b7V5yo5QF
InChI InChI=1S/C17H29BrO2/c1-14(8-5-6-13-19)9-7-10-15(2)11-12-16(18)17(3,4)20/h8,10,13,16,20H,5-7,9,11-12H2,1-4H3/b14-8+,15-10+
InChIKey ZARCBEMXBDDHDW-UYSZGSBFSA-N
Mol Weight 345.32 g/mol
Molecular Formula C17H29BrO2
Exact Mass 344.135093 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2XzWZJgBQem
Name 4,8-Tetradecadienal, 12-bromo-13-hydroxy-5,9,13-trimethyl-, (E,E)-(.+-.)-
Alternate Name(s) (4E,8E)-12-bromo-13-hydroxy-5,9,13-trimethyl-4,8-tetradecadienal (4E,8E)-12-bromo-13-hydroxy-5,9,13-trimethyltetradeca-4,8-dienal
CAS Registry Number 118198-31-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H29BrO2
InChI InChI=1S/C17H29BrO2/c1-14(8-5-6-13-19)9-7-10-15(2)11-12-16(18)17(3,4)20/h8,10,13,16,20H,5-7,9,11-12H2,1-4H3/b14-8+,15-10+
InChIKey ZARCBEMXBDDHDW-UYSZGSBFSA-N
Molecular Weight 345.321 g/mol
SMILES OC(C(CC\C(=C\CC\C(=C\CCC=O)C)C)Br)(C)C
SPLASH splash10-001i-9301000000-333fefa956c10ad7f91c
Source of Spectrum KC-1988-466-21
Wiley ID 1337780