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6-(3-Chlorobenzoyloxy)-3,8-di-tert-butyl-2,2,9,9-tetramethyl-3,6,7-decatrien-5-one
SpectraBase Compound ID H4T0nUaxn6m
InChI InChI=1S/C29H41ClO3/c1-26(2,3)23(27(4,5)6)17-21(31)22(18-24(28(7,8)9)29(10,11)12)33-25(32)19-14-13-15-20(30)16-19/h13-17H,1-12H3
InChIKey RSGQSSFNQMUOBQ-UHFFFAOYSA-N
Mol Weight 473.1 g/mol
Molecular Formula C29H41ClO3
Exact Mass 472.274423 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 83lDjGU6MHl
Name 6-(3-Chlorobenzoyloxy)-3,8-di-tert-butyl-2,2,9,9-tetramethyl-3,6,7-decatrien-5-one
CAS Registry Number 141824-14-8
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H41ClO3
InChI InChI=1S/C29H41ClO3/c1-26(2,3)23(27(4,5)6)17-21(31)22(18-24(28(7,8)9)29(10,11)12)33-25(32)19-14-13-15-20(30)16-19/h13-17H,1-12H3
InChIKey RSGQSSFNQMUOBQ-UHFFFAOYSA-N
Molecular Weight 473.097 g/mol
SMILES C(=C=C(C(C)(C)C)C(C)(C)C)(C(C=C(C(C)(C)C)C(C)(C)C)=O)OC(c1cc(Cl)ccc1)=O
SPLASH splash10-014r-3900000000-93435adf5b70378d27bd
Source of Spectrum C-114-6001-5
Synonyms 3-tert-Butyl-1-(3-tert-butyl-4,4-dimethyl-2-pentenoyl)-4,4-dimethyl-1,2-pentadienyl 3-chlorobenzoate
Wiley ID 1393451