| SpectraBase Spectrum ID |
JFf3sUq2jmy |
| Name |
Diisooctylphthalate |
| CAS Registry Number |
27554-26-3 |
| Classification |
Softener |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
390.277009700 u |
| Formula |
C24H38O4 |
| InChI |
InChI=1S/C24H38O4/c1-5-11-19(7-3)15-17-27-23(25)21-13-9-10-14-22(21)24(26)28-18-16-20(8-4)12-6-2/h9-10,13-14,19-20H,5-8,11-12,15-18H2,1-4H3 |
| InChIKey |
YRNLSZDULHGYET-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
390.564 g/mol |
| Nominal Mass |
390 u |
| Quality |
959 |
| Retention Index |
2798 |
| SMILES |
C=1(C(C(OCCC(CCC)CC)=O)=CC=CC1)C(OCCC(CCC)CC)=O |
| SPLASH |
splash10-00kb-2900000000-414fa4997dc870798eaf |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Bis(3-ethylhexyl)benzene-1,2-dicarboxylate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_009589 |
