SpectraBase Spectrum ID |
2UbMtqpnAJb |
Name |
4-Cyanobenzoic acid, 2-methyloct-5-yn-4-yl ester |
Alternate Name(s) |
4-cyanobenzoic acid 2-methyloct-5-yn-4-yl ester
1-isobutylpent-2-ynyl 4-cyanobenzoate
2-Methyloct-5-yn-4-yl 4-cyanobenzoate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C17H19NO2 |
InChI |
InChI=1S/C17H19NO2/c1-4-5-6-16(11-13(2)3)20-17(19)15-9-7-14(12-18)8-10-15/h7-10,13,16H,4,11H2,1-3H3 |
InChIKey |
MOIOXTMHXLNGKS-UHFFFAOYSA-N |
Molecular Weight |
269.344 g/mol |
SMILES |
c1c(ccc(c1)C(OC(CC(C)C)C#CCC)=O)C#N |
SPLASH |
splash10-001l-9700000000-1d33644789ce6b9b578c |
Source of Spectrum |
NP-8-2704-0 |
Wiley ID |
1107169 |