| SpectraBase Spectrum ID |
1xOskT7GGsv |
| Name |
1-[1-Hydroxy-3-methyl-1-(2-methylallyl)but-3-enyl]cyclopentanecarboxylic acid ethyl ester |
| Comments |
Note: The molecular formula of the structure shown is C17H28O3 - which differs from the formula reported for the mass spectrum (C16H24O3) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H24O3 |
| InChI |
InChI=1S/C17H28O3/c1-6-20-15(18)16(9-7-8-10-16)17(19,11-13(2)3)12-14(4)5/h19H,2,4,6-12H2,1,3,5H3 |
| InChIKey |
LCFKLBJWEXJRLQ-UHFFFAOYSA-N |
| Molecular Weight |
280.408 g/mol |
| SMILES |
OC(C1(C(OCC)=O)CCCC1)(CC(=C)C)CC(=C)C |
| SPLASH |
splash10-0007-2900000000-5097cf6142711f61afe6 |
| Source of Spectrum |
SO-0-147-3 |
| Wiley ID |
864008 |
![1-[1-Hydroxy-3-methyl-1-(2-methylallyl)but-3-enyl]cyclopentanecarboxylic acid ethyl ester](/api/spectrum/1xOskT7GGsv/structure.png?h=300&w=458 "1-[1-Hydroxy-3-methyl-1-(2-methylallyl)but-3-enyl]cyclopentanecarboxylic acid ethyl ester")
