| SpectraBase Spectrum ID |
6bB9gI0AhAN |
| Name |
1-Methylheptyl 4-methylbenzoate |
| Alternate Name(s) |
4-Methylbenzoic acid 1-methylheptyl ester
4-Methylbenzoic acid octan-2-yl ester
Octan-2-yl 4-methylbenzoate
p-Toluic acid, 2-octyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H24O2 |
| InChI |
InChI=1S/C16H24O2/c1-4-5-6-7-8-14(3)18-16(17)15-11-9-13(2)10-12-15/h9-12,14H,4-8H2,1-3H3 |
| InChIKey |
RNZXEXQHGNXATD-UHFFFAOYSA-N |
| Molecular Weight |
248.366 g/mol |
| SMILES |
C(OC(CCCCCC)C)(c1ccc(cc1)C)=O |
| SPLASH |
splash10-014l-9800000000-33b3abf893b5a21d19fb |
| Source of Spectrum |
IC-682-0-0 |
| Wiley ID |
1251591 |
