| SpectraBase Spectrum ID |
2oO9q7UyTaq |
| Name |
4-Butylbenzoic acid anhydride |
| Classification |
Chemical |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
338.188194694 u |
| Formula |
C22H26O3 |
| InChI |
InChI=1S/C22H26O3/c1-3-5-7-17-9-13-19(14-10-17)21(23)25-22(24)20-15-11-18(12-16-20)8-6-4-2/h9-16H,3-8H2,1-2H3 |
| InChIKey |
XXUKTDGSTTXZEL-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
338.447 g/mol |
| Nominal Mass |
338 u |
| Quality |
999 |
| Retention Index |
2797 |
| SMILES |
C=1(C(OC(C=2C=CC(=CC2)CCCC)=O)=O)C=CC(=CC1)CCCC |
| SPLASH |
splash10-03di-3911000000-7b5ebafc7eca3a0d431d |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
4-butylbenzoyl 4-butylbenzoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_025334 |
