| SpectraBase Spectrum ID |
8K4kUMw4rC4 |
| Name |
1,3-Butandiol dibenzoate |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
298.120509056 u |
| Formula |
C18H18O4 |
| InChI |
InChI=1S/C18H18O4/c1-14(22-18(20)16-10-6-3-7-11-16)12-13-21-17(19)15-8-4-2-5-9-15/h2-11,14H,12-13H2,1H3 |
| InChIKey |
HVWZDMVPWXVEBP-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
298.338 g/mol |
| Nominal Mass |
298 u |
| Quality |
777 |
| Retention Index |
2198 |
| SMILES |
C(C1=CC=CC=C1)(OC(CCOC(C1=CC=CC=C1)=O)C)=O |
| SPLASH |
splash10-0a4i-1900000000-68f4e48e012e1a0de3ef |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Technique |
GC/MS |
| Wiley ID |
DD2024_000381 |
