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1,3-bis(4-oct-7-enylphenyl)-2-propyn-1-ol
SpectraBase Compound ID LtrJmn5sVmg
InChI InChI=1S/C31H40O/c1-3-5-7-9-11-13-15-27-17-19-29(20-18-27)23-26-31(32)30-24-21-28(22-25-30)16-14-12-10-8-6-4-2/h3-4,17-22,24-25,31-32H,1-2,5-16H2
InChIKey RBBVWURCISPCPG-UHFFFAOYSA-N
Mol Weight 428.7 g/mol
Molecular Formula C31H40O
Exact Mass 428.307916 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3WGODhVMBlK
Name 1,3-bis(4-oct-7-enylphenyl)-2-propyn-1-ol
Alternate Name(s) 1,3-bis(4-oct-7-enylphenyl)prop-2-yn-1-ol
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H40O
InChI InChI=1S/C31H40O/c1-3-5-7-9-11-13-15-27-17-19-29(20-18-27)23-26-31(32)30-24-21-28(22-25-30)16-14-12-10-8-6-4-2/h3-4,17-22,24-25,31-32H,1-2,5-16H2
InChIKey RBBVWURCISPCPG-UHFFFAOYSA-N
Molecular Weight 428.660 g/mol
SMILES OC(C#Cc1ccc(cc1)CCCCCCC=C)c1ccc(cc1)CCCCCCC=C
SPLASH splash10-03di-0000900000-e91aec8f6ad9dea7a494
Source of Spectrum H-2005-2327-11
Wiley ID 1562840