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2'-Isopropyl-5'-methylcyclohexyl 3-(3,5-di-tert-butyl-4-hydroxy)phenylpropanoate
SpectraBase Compound ID 1IonTd9RTyH
InChI InChI=1S/C27H44O3/c1-17(2)20-12-10-18(3)14-23(20)30-24(28)13-11-19-15-21(26(4,5)6)25(29)22(16-19)27(7,8)9/h15-18,20,23,29H,10-14H2,1-9H3
InChIKey ZXWRVOKOKBZCMM-UHFFFAOYSA-N
Mol Weight 416.6 g/mol
Molecular Formula C27H44O3
Exact Mass 416.329045 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2lrfMIEUBJx
Name 2'-Isopropyl-5'-methylcyclohexyl 3-(3,5-di-tert-butyl-4-hydroxy)phenylpropanoate
Alternate Name(s) (1'R*,2'S*,5'R*)-2'-Isopropyl-5'-methylcyclohexyl 3-(3,5-di-tert-butyl-4-hydroxy)phenylpropanoate 2-isopropyl-5-methylcyclohexyl 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H44O3
InChI InChI=1S/C27H44O3/c1-17(2)20-12-10-18(3)14-23(20)30-24(28)13-11-19-15-21(26(4,5)6)25(29)22(16-19)27(7,8)9/h15-18,20,23,29H,10-14H2,1-9H3
InChIKey ZXWRVOKOKBZCMM-UHFFFAOYSA-N
Molecular Weight 416.646 g/mol
SMILES Oc1c(C(C)(C)C)cc(cc1C(C)(C)C)CCC(OC1C(CCC(C1)C)C(C)C)=O
SPLASH splash10-014i-0090800000-46ea63de622e973954a4
Source of Spectrum F-70-1338-3
Wiley ID 1596243