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1,7-bis[ 2',5'-(Diisopropyl)-4'-hydroxyphenyl)-1,6-heptadiene-3,5-dione
SpectraBase Compound ID Fxc8ukO3YZs
InChI InChI=1S/C31H40O4/c1-18(2)26-16-30(34)28(20(5)6)13-22(26)9-11-24(32)15-25(33)12-10-23-14-29(21(7)8)31(35)17-27(23)19(3)4/h9-14,16-21,34-35H,15H2,1-8H3/b11-9+,12-10+
InChIKey DOLOFKKHRYPSEF-WGDLNXRISA-N
Mol Weight 476.7 g/mol
Molecular Formula C31H40O4
Exact Mass 476.29266 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1OpNT3ImWtW
Name 1,7-bis[ 2',5'-(Diisopropyl)-4'-hydroxyphenyl)-1,6-heptadiene-3,5-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H40O4
InChI InChI=1S/C31H40O4/c1-18(2)26-16-30(34)28(20(5)6)13-22(26)9-11-24(32)15-25(33)12-10-23-14-29(21(7)8)31(35)17-27(23)19(3)4/h9-14,16-21,34-35H,15H2,1-8H3/b11-9+,12-10+
InChIKey DOLOFKKHRYPSEF-WGDLNXRISA-N
Molecular Weight 476.657 g/mol
SMILES Oc1cc(c(\C=C\C(CC(\C=C\c2c(cc(c(c2)C(C)C)O)C(C)C)=O)=O)cc1C(C)C)C(C)C
SPLASH splash10-001i-0965400000-49493b8683606c16215b
Source of Spectrum O-33-321-23
Wiley ID 763268