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1,4-Benzenediheptanoic acid, 2,3,5,6-tetramethyl-
SpectraBase Compound ID IT0yZwrzrQE
InChI InChI=1S/C24H38O4/c1-17-18(2)22(14-10-6-8-12-16-24(27)28)20(4)19(3)21(17)13-9-5-7-11-15-23(25)26/h5-16H2,1-4H3,(H,25,26)(H,27,28)
InChIKey YGLLFONRCMBLAP-UHFFFAOYSA-N
Mol Weight 390.6 g/mol
Molecular Formula C24H38O4
Exact Mass 390.27701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3hAPxqO2q0
Name 1,4-Benzenediheptanoic acid, 2,3,5,6-tetramethyl-
Alternate Name(s) 1,4-bis(6-hydroxycarbonylhexyl)-2,3,5,6-tetramethylbenzene 7-[4-(6-carboxyhexyl)-2,3,5,6-tetramethylphenyl]heptanoic acid
CAS Registry Number 118214-36-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H38O4
InChI InChI=1S/C24H38O4/c1-17-18(2)22(14-10-6-8-12-16-24(27)28)20(4)19(3)21(17)13-9-5-7-11-15-23(25)26/h5-16H2,1-4H3,(H,25,26)(H,27,28)
InChIKey YGLLFONRCMBLAP-UHFFFAOYSA-N
Molecular Weight 390.564 g/mol
SMILES OC(CCCCCCc1c(c(c(CCCCCCC(=O)O)c(c1C)C)C)C)=O
SPLASH splash10-03fv-0923000000-507f0d08ea9955068fa0
Source of Spectrum I-66-2068-18
Wiley ID 1365080