| SpectraBase Spectrum ID |
JJ4VbLwqQQi |
| Name |
Phthalicacid butyl hexyl ester |
| CAS Registry Number |
17851-53-5 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
306.183109313 u |
| Formula |
C18H26O4 |
| InChI |
InChI=1S/C18H26O4/c1-3-5-7-10-14-22-18(20)16-12-9-8-11-15(16)17(19)21-13-6-4-2/h8-9,11-12H,3-7,10,13-14H2,1-2H3 |
| InChIKey |
LKVQWLUFJXBHKH-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
306.402 g/mol |
| Nominal Mass |
306 u |
| Quality |
921 |
| Retention Index |
2197 |
| SMILES |
C=1(C(C(OCCCC)=O)=CC=CC1)C(OCCCCCC)=O |
| SPLASH |
splash10-0002-1900000000-64c09ee1cea03348ff6d |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-butyl 2-hexyl benzene-1,2-dicarboxylate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_003642 |
