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Phthalic acid, didecyl ester
SpectraBase Compound ID 42w8yfnT2fr
InChI InChI=1S/C28H46O4/c1-3-5-7-9-11-13-15-19-23-31-27(29)25-21-17-18-22-26(25)28(30)32-24-20-16-14-12-10-8-6-4-2/h17-18,21-22H,3-16,19-20,23-24H2,1-2H3
InChIKey PGIBJVOPLXHHGS-UHFFFAOYSA-N
Mol Weight 446.7 g/mol
Molecular Formula C28H46O4
Exact Mass 446.33961 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B8EPXXZrwz9
Name PHTHALIC ACID -BIS-DECYLESTER
CAS Registry Number 84-77-5
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 446.339609957 u
Formula C28H46O4
InChI InChI=1S/C28H46O4/c1-3-5-7-9-11-13-15-19-23-31-27(29)25-21-17-18-22-26(25)28(30)32-24-20-16-14-12-10-8-6-4-2/h17-18,21-22H,3-16,19-20,23-24H2,1-2H3
InChIKey PGIBJVOPLXHHGS-UHFFFAOYSA-N
Molecular Weight 446.672 g/mol
Nominal Mass 446 u
Number of Peaks 102
SMILES c1(C(=O)OCCCCCCCCCC)c(cccc1)C(OCCCCCCCCCC)=O
SPLASH splash10-052g-9500000000-8cba54279ce3261590b3
Source of Spectrum Dr. Rolf Kuehnle
Synonyms didecyl phthalate
Technique GC/MS
Wiley ID WID_MSPA_4414