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Di-2-Methylbutyl-phthalate
SpectraBase Compound ID AVzRzjgZX2F
InChI InChI=1S/C18H26O4/c1-5-13(3)11-21-17(19)15-9-7-8-10-16(15)18(20)22-12-14(4)6-2/h7-10,13-14H,5-6,11-12H2,1-4H3
InChIKey MZLKGKRQKLIVBS-UHFFFAOYSA-N
Mol Weight 306.4 g/mol
Molecular Formula C18H26O4
Exact Mass 306.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JF9uoF6gLOi
Name Di-2-Methylbutyl-phthalate
Classification Softener
Comments Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found)
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 306.183109313 u
Formula C18H26O4
InChI InChI=1S/C18H26O4/c1-5-13(3)11-21-17(19)15-9-7-8-10-16(15)18(20)22-12-14(4)6-2/h7-10,13-14H,5-6,11-12H2,1-4H3
InChIKey MZLKGKRQKLIVBS-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 306.402 g/mol
Nominal Mass 306 u
Quality 866
Retention Index 2197
SMILES C=1(C(C(OCC(CC)C)=O)=CC=CC1)C(OCC(CC)C)=O
SPLASH splash10-0002-3910000000-cc999739dfa5e86b2877
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Phthalicacid,di(2-methylbutyl) ester bis(2-methylbutyl) benzene-1,2-dicarboxylate
Technique GC/MS
Wiley ID DD2024_013829