SpectraBase Spectrum ID |
6nozh7xmUyi |
Name |
Phthalic acid, heptyl hex-2-yn-4-yl ester |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H28O4 |
InChI |
InChI=1S/C21H28O4/c1-4-7-8-9-12-16-24-20(22)18-14-10-11-15-19(18)21(23)25-17(6-3)13-5-2/h10-11,14-15,17H,4,6-9,12,16H2,1-3H3 |
InChIKey |
VMUPYDCDHLMNFE-UHFFFAOYSA-N |
Molecular Weight |
344.451 g/mol |
SMILES |
C(c1c(cccc1)C(=O)OCCCCCCC)(OC(CC)C#CC)=O |
SPLASH |
splash10-0002-2900000000-0d6a01d3a3c5acfced8f |
Source of Spectrum |
NP-12-4476-0 |
Synonyms |
benzene-1,2-dicarboxylic acid O1-heptyl ester O2-hex-4-yn-3-yl ester
1-O-heptyl 2-O-hex-4-yn-3-yl benzene-1,2-dicarboxylate
O2-(1-ethylbut-2-ynyl) O1-heptyl benzene-1,2-dicarboxylate
O1-heptyl O2-hex-4-yn-3-yl benzene-1,2-dicarboxylate |
Wiley ID |
1110322 |