| SpectraBase Spectrum ID |
HjShcCAwnui |
| Name |
Diethyl terephthalate |
| CAS Registry Number |
636-09-9 |
| 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 |
222.089208927 u |
| Formula |
C12H14O4 |
| InChI |
InChI=1S/C12H14O4/c1-3-15-11(13)9-5-7-10(8-6-9)12(14)16-4-2/h5-8H,3-4H2,1-2H3 |
| InChIKey |
ONIHPYYWNBVMID-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
222.240 g/mol |
| Nominal Mass |
222 u |
| Quality |
919 |
| Retention Index |
1597 |
| SMILES |
C=1(C(OCC)=O)C=CC(C(OCC)=O)=CC1 |
| SPLASH |
splash10-004i-2900000000-6ee11e17122af7f44891 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1,4-Benzenedicarboxylicacid 2ET
1,4-Benzenedicarboxylicacid,diethyl ester
diethyl benzene-1,4-dicarboxylate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_018295 |
