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3-(2-Acetoxy-5-tert-butyl-phenyl)acrylic acid 3,7-dimethyl-oct-6-enyl ester
SpectraBase Compound ID R5C37IfdkV
InChI InChI=1S/C25H36O4/c1-18(2)9-8-10-19(3)15-16-28-24(27)14-11-21-17-22(25(5,6)7)12-13-23(21)29-20(4)26/h9,11-14,17,19H,8,10,15-16H2,1-7H3
InChIKey GIDKILWJYXSHCI-UHFFFAOYSA-N
Mol Weight 400.6 g/mol
Molecular Formula C25H36O4
Exact Mass 400.26136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4hFLabGMOCK
Name 3-(2-Acetoxy-5-tert-butyl-phenyl)acrylic acid 3,7-dimethyl-oct-6-enyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H36O4
InChI InChI=1S/C25H36O4/c1-18(2)9-8-10-19(3)15-16-28-24(27)14-11-21-17-22(25(5,6)7)12-13-23(21)29-20(4)26/h9,11-14,17,19H,8,10,15-16H2,1-7H3
InChIKey GIDKILWJYXSHCI-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 400.559 g/mol
SMILES C(C)(=O)Oc1c(C=CC(=O)OCCC(C)CCC=C(C)C)cc(C(C)(C)C)cc1
SPLASH splash10-0f79-0980000000-72e103f68d3e2de38a18
Source of Spectrum US20100137627A1
Wiley ID 1842330