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Phthalic acid, butyl ester, ester with butyl glycolate
SpectraBase Compound ID CM8B97tUOi2
InChI InChI=1S/C18H24O6/c1-3-5-11-22-16(19)13-24-18(21)15-10-8-7-9-14(15)17(20)23-12-6-4-2/h7-10H,3-6,11-13H2,1-2H3
InChIKey GOJCZVPJCKEBQV-UHFFFAOYSA-N
Mol Weight 336.38 g/mol
Molecular Formula C18H24O6
Exact Mass 336.157288 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JHofxXhPFFQ
Name (Butoxycarbonylmethyl)butylphthalate
CAS Registry Number 85-69-8
Classification Softener
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 336.157288487 u
Formula C18H24O6
InChI InChI=1S/C18H24O6/c1-3-5-11-22-16(19)13-24-18(21)15-10-8-7-9-14(15)17(20)23-12-6-4-2/h7-10H,3-6,11-13H2,1-2H3
InChIKey GOJCZVPJCKEBQV-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 336.384 g/mol
Nominal Mass 336 u
Quality 993
Retention Index 2403
SMILES C=1(C(C(OCCCC)=O)=CC=CC1)C(OCC(OCCCC)=O)=O
SPLASH splash10-0002-2900000000-8eea938891766315ab13
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Butyl phthalyl butyl glycolate
Technique GC/MS
Wiley ID DD2024_023549