| SpectraBase Spectrum ID |
KhkpKtWK94f |
| Name |
Phthalate |
| Source of Sample |
SAFC Cat.no. W508500 |
| CAS Registry Number |
131-11-3 |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
194.057908798 u |
| Formula |
C10H10O4 |
| InChI |
InChI=1S/C10H10O4/c1-13-9(11)7-5-3-4-6-8(7)10(12)14-2/h3-6H,1-2H3 |
| InChIKey |
NIQCNGHVCWTJSM-UHFFFAOYSA-N |
| Molecular Weight |
194.186 g/mol |
| Number of Peaks |
50 |
| RI1 |
1451 |
| RI2 |
1129 |
| RI3 |
1631 |
| RI4 |
1590 |
| SMILES |
c1ccc(c(c1)C(OC)=O)C(OC)=O |
| SPLASH |
splash10-03di-6900000000-b667453752d249c7d630 |
| Sample Comments |
RI1: measured on SLB-5ms (Hydro)
RI2: measured on SLB-5ms (FAMEs)
RI3: measured on Supelcowax-10 (FAMEs)
RI4: measured on Supelcowax-10 (FAEEs)
RI5: measured on Equity-1 (Hydro) |
| Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
| Synonyms |
1,2-Benzenedicarboxylic acid, dimethyl ester |
| Wiley ID |
LM_FFNSC3_242 |
