| SpectraBase Spectrum ID |
64K2Dt5R5aw |
| Name |
1-Propylhept-2-ynyl benzoate |
| Alternate Name(s) |
benzoic acid 1-propylhept-2-ynyl ester
benzoic acid dec-5-yn-4-yl ester
dec-5-yn-4-yl benzoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H22O2 |
| InChI |
InChI=1S/C17H22O2/c1-3-5-6-10-14-16(11-4-2)19-17(18)15-12-8-7-9-13-15/h7-9,12-13,16H,3-6,11H2,1-2H3 |
| InChIKey |
DZLDLHZCZKCUQD-UHFFFAOYSA-N |
| Molecular Weight |
258.361 g/mol |
| SMILES |
C(c1ccccc1)(=O)OC(CCC)C#CCCCC |
| SPLASH |
splash10-0a4i-0910000000-94828b4043cbe96182f2 |
| Source of Spectrum |
SO-0-70-4 |
| Wiley ID |
1541916 |
