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3,5-bis(oct-1-enyl)benzoic acid

View entire compound with spectra: 1 MS (GC)

3,5-bis(oct-1-enyl)benzoic acid
SpectraBase Compound ID F01lclbFIru
InChI InChI=1S/C23H34O2/c1-3-5-7-9-11-13-15-20-17-21(19-22(18-20)23(24)25)16-14-12-10-8-6-4-2/h13-19H,3-12H2,1-2H3,(H,24,25)/b15-13-,16-14+
InChIKey RWBDHBPRXSAUBO-VCFJNTAESA-N
Mol Weight 342.5 g/mol
Molecular Formula C23H34O2
Exact Mass 342.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BwECW58Kvtb
Name 3,5-bis(oct-1-enyl)benzoic acid
Alternate Name(s) 3,5-bis(Oct-1'-enyl)benzoic acid 3-[(1E)-1-octenyl]-5-[(1Z)-1-octenyl]benzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H34O2
InChI InChI=1S/C23H34O2/c1-3-5-7-9-11-13-15-20-17-21(19-22(18-20)23(24)25)16-14-12-10-8-6-4-2/h13-19H,3-12H2,1-2H3,(H,24,25)/b15-13-,16-14+
InChIKey RWBDHBPRXSAUBO-VCFJNTAESA-N
Molecular Weight 342.523 g/mol
SMILES OC(c1cc(\C=C/CCCCCC)cc(c1)\C=C\CCCCCC)=O
SPLASH splash10-03xv-5952000000-7cedd74c08b3a6508b44
Source of Spectrum JA-50-425-0
Wiley ID 1337014