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Phthalate (Di-N-pentyl)
SpectraBase Compound ID 66Hu9p5Urvb
InChI InChI=1S/C18H26O4/c1-3-5-9-13-21-17(19)15-11-7-8-12-16(15)18(20)22-14-10-6-4-2/h7-8,11-12H,3-6,9-10,13-14H2,1-2H3
InChIKey IPKKHRVROFYTEK-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 KsYOtGUSPHD
Name Phthalate (Di-N-pentyl)
Copyright Copyright © 2012-2024 John Wiley & Sons, Inc. Portions provided by AAFS, Toxicology Section. All Rights Reserved.
Formula C18H26O4
InChI InChI=1S/C18H26O4/c1-3-5-9-13-21-17(19)15-11-7-8-12-16(15)18(20)22-14-10-6-4-2/h7-8,11-12H,3-6,9-10,13-14H2,1-2H3
InChIKey IPKKHRVROFYTEK-UHFFFAOYSA-N
SMILES c1ccc(c(c1)C(OCCCCC)=O)C(OCCCCC)=O
SPLASH splash10-0002-1900000000-99bfb9b5c8b776b97ffa
Source of Spectrum Mass Spectrometry Committee of the Toxicology Section of the American Academy of Forensic Sciences
Synonyms Phthalic acid. di-n-pentyl ester