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1,2-Benzenedicarboxylic acid decyl octyl ester
SpectraBase Compound ID fixkvOgBPh
InChI InChI=1S/C26H42O4/c1-3-5-7-9-11-12-14-18-22-30-26(28)24-20-16-15-19-23(24)25(27)29-21-17-13-10-8-6-4-2/h15-16,19-20H,3-14,17-18,21-22H2,1-2H3
InChIKey LVAGMBHLXLZJKZ-UHFFFAOYSA-N
Mol Weight 418.6 g/mol
Molecular Formula C26H42O4
Exact Mass 418.30831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8mSkGP405tF
Name Decyloctylphthalate @
CAS Registry Number 119-07-3
Classification Softener
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Exact Mass 418.308309828 u
Formula C26H42O4
InChI InChI=1S/C26H42O4/c1-3-5-7-9-11-12-14-18-22-30-26(28)24-20-16-15-19-23(24)25(27)29-21-17-13-10-8-6-4-2/h15-16,19-20H,3-14,17-18,21-22H2,1-2H3
InChIKey LVAGMBHLXLZJKZ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 418.618 g/mol
SMILES c1cc(C(OCCCCCCCCCC)=O)c(cc1)C(=O)OCCCCCCCC
SPLASH splash10-052b-7910000000-a1458907fef7daf04ea9
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms Phthalic acid decyloctyl ester
Technique GC/MS
Wiley ID MMPW6e_3544