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(5E)-4,8-ditert-butyl-2,2,9,9-tetramethyl-deca-5,7-dien-3-one
SpectraBase Compound ID 2RoWeVvXP6c
InChI InChI=1S/C22H40O/c1-19(2,3)16(18(23)22(10,11)12)14-13-15-17(20(4,5)6)21(7,8)9/h13-16H,1-12H3/b14-13+
InChIKey KTCSUHCTRHGRCO-BUHFOSPRSA-N
Mol Weight 320.6 g/mol
Molecular Formula C22H40O
Exact Mass 320.307916 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HOvCTuGPSlT
Name (5E)-4,8-ditert-butyl-2,2,9,9-tetramethyl-deca-5,7-dien-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H40O
InChI InChI=1S/C22H40O/c1-19(2,3)16(18(23)22(10,11)12)14-13-15-17(20(4,5)6)21(7,8)9/h13-16H,1-12H3/b14-13+
InChIKey KTCSUHCTRHGRCO-BUHFOSPRSA-N
Instrument Name FINNIGANTSQ 700
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.11.139
Molecular Weight 320.561 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
SPLASH splash10-0a4i-6900000000-0bd3130d125362ff1961
Source of Spectrum BJO-11-SM12-31
Wiley ID 1851501