Benzyl butyl phthalate

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Systematic / IUPAC Name: 2-O-Benzyl 1-O-butyl benzene-1,2-dicarboxylate

ID: Reference29

Other Names: Butyl benzyl phthalate;
n-Butyl benzyl phthalate;
Benzyl n-butyl phthalate;
Phthalic acid benzyl butyl ester;
Butyl phenylmethyl 1,2-benzenedicarboxylate ; more

Formula: C19H20O4

Class: Industrial Chemicals

Spectral Data

Benzyl butyl phthalate mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap; Q Exactive Plus Orbitrap
No. of Spectral Trees 3
No. of Spectra 181
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 1/15/2015 10:31:40 AM
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Identificators

InChI InChI=1S/C19H20O4/c1-2-3-13-22-18(20)16-11-7-8-12-17(16)19(21)23-14-15-9-5-4-6-10-15/h4-12H,2-3,13-14H2,1H3
InChI Key IRIAEXORFWYRCZ-UHFFFAOYSA-N
Canonical SMILES CCCCOC(=O)C1=CC=CC=C1C(=O)OCC2=CC=CC=C2
CAS 85687
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Other Names Butyl benzyl phthalate;
n-Butyl benzyl phthalate;
Benzyl n-butyl phthalate;
Phthalic acid benzyl butyl ester;
Butyl phenylmethyl 1,2-benzenedicarboxylate;
1,2-Benzenedicarboxylic acid, 1-butyl 2-(phenylmethyl) ester;
1,2-Benzenedicarboxylic acid butyl phenylmethyl ester;
Sicol;
Palatinol BB;
Spatozoate;
Santicizer S 160

In Other Databases

KEGG C14211
PubChem 2347
ChemIDPlus 000085687
WebBook 1110219178
ChemSpider 2257
ChEMBL CHEMBL1450327
Wikipedia Benzyl butyl phthalate