| SpectraBase Spectrum ID |
JJQpLsONRWC |
| Name |
Phthalic acid diisononyl ester |
| CAS Registry Number |
28553-12-0 |
| Classification |
Softener |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
418.308309828 u |
| Formula |
C26H42O4 |
| InChI |
InChI=1S/C26H42O4/c1-21(2)15-9-5-7-13-19-29-25(27)23-17-11-12-18-24(23)26(28)30-20-14-8-6-10-16-22(3)4/h11-12,17-18,21-22H,5-10,13-16,19-20H2,1-4H3 |
| InChIKey |
HBGGXOJOCNVPFY-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
418.618 g/mol |
| Nominal Mass |
418 u |
| Quality |
969 |
| Retention Index |
2998 |
| SMILES |
C=1(C(C(OCCCCCCC(C)C)=O)=CC=CC1)C(OCCCCCCC(C)C)=O |
| SPLASH |
splash10-0002-8910000000-aa9ef3f30517f1df2888 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Diisononylphthalate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_026904 |
