| SpectraBase Spectrum ID |
JHwmOd6Htg0 |
| Name |
4-Ethylbenzoic acid anhydride |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
282.125594437 u |
| Formula |
C18H18O3 |
| InChI |
InChI=1S/C18H18O3/c1-3-13-5-9-15(10-6-13)17(19)21-18(20)16-11-7-14(4-2)8-12-16/h5-12H,3-4H2,1-2H3 |
| InChIKey |
ZUGCMGHPUFMRJP-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
282.339 g/mol |
| Nominal Mass |
282 u |
| Quality |
999 |
| Retention Index |
2335 |
| SMILES |
C1(C(OC(C=2C=CC(=CC2)CC)=O)=O)=CC=C(C=C1)CC |
| SPLASH |
splash10-001i-4900000000-97a91e3e80843c5a94da |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
4-ethylbenzoic anhydride |
| Technique |
GC/MS |
| Wiley ID |
DD2024_032986 |
