| SpectraBase Spectrum ID |
3Gtt97tgxs |
| Name |
Isoamyl ortho toluate |
| Alternate Name(s) |
ortho-Toluic acid isoamyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H18O2 |
| InChI |
InChI=1S/C13H18O2/c1-10(2)8-9-15-13(14)12-7-5-4-6-11(12)3/h4-7,10H,8-9H2,1-3H3 |
| InChIKey |
ZMSLAZFPMYEGIT-UHFFFAOYSA-N |
| Ionization Type |
EI-B |
| Molecular Weight |
206.285 g/mol |
| SMILES |
CC(C)CCOC(=O)c1ccccc1C |
| SPLASH |
splash10-01bc-9500000000-468254283a8d0fcb2fb8 |
| Source of Spectrum |
SRH-2022-59-0 |
| Wiley ID |
1822602 |
