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methyl 2-hydroxy-3,6-dimethyl-4-((4,8,12-trimethyltrideca-3,7,11-trien-1-yl)oxy)benzoate
SpectraBase Compound ID 3E24YrdvAiA
InChI InChI=1S/C26H38O4/c1-18(2)11-8-12-19(3)13-9-14-20(4)15-10-16-30-23-17-21(5)24(26(28)29-7)25(27)22(23)6/h11,13,15,17,27H,8-10,12,14,16H2,1-7H3
InChIKey ZKUNTTKAGHRZTK-UHFFFAOYSA-N
Mol Weight 414.6 g/mol
Molecular Formula C26H38O4
Exact Mass 414.27701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4t37Z0HcvuM
Name methyl 2-hydroxy-3,6-dimethyl-4-((4,8,12-trimethyltrideca-3,7,11-trien-1-yl)oxy)benzoate
Appearance Colorless liquid
Carrier Gas Helium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 414.277009700 u
Formula C26H38O4
GC Oven Program Oven temp 250oC
InChI InChI=1S/C26H38O4/c1-18(2)11-8-12-19(3)13-9-14-20(4)15-10-16-30-23-17-21(5)24(26(28)29-7)25(27)22(23)6/h11,13,15,17,27H,8-10,12,14,16H2,1-7H3
InChIKey ZKUNTTKAGHRZTK-UHFFFAOYSA-N
Inlet Type Splitless
Instrument Name GCMS
Ionization Type EI
Molecular Weight 414.586 g/mol
Quality 160
SMILES OC1=C(C(OC)=O)C(=CC(=C1C)OCCC=C(CCC=C(CCC=C(C)C)C)C)C
SPLASH splash10-1004-2590000000-e106df0967cedcbff2a2
Sample Comments Mixture of E/Z isomers
Source of Spectrum WO2023067040A1
Wiley ID 1897212