| SpectraBase Spectrum ID |
B58URHfilff |
| Name |
(5S,6R)-6-Heptyl-5-hydroxy-2-methyl-5,6-dihydro-4H-pyran-3-carboxylic acid ethyl ester |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H28O4 |
| InChI |
InChI=1S/C16H28O4/c1-4-6-7-8-9-10-15-14(17)11-13(12(3)20-15)16(18)19-5-2/h14-15,17H,4-11H2,1-3H3/t14-,15+/m0/s1 |
| InChIKey |
WRINTKYFNHMBLK-LSDHHAIUSA-N |
| Molecular Weight |
284.396 g/mol |
| SMILES |
O[C@@]1([C@](CCCCCCC)([H])OC(=C(C1)C(=O)OCC)C)[H] |
| SPLASH |
splash10-0006-9000000000-715a42f3f0e5661028dc |
| Source of Spectrum |
C-126-9655-9a |
| Synonyms |
(trans)-2-Heptyl-3-hydroxy-5-(ethoxycarbonyl)-6-methyl-3,4-dihydro-2H-pyran |
| Wiley ID |
1701354 |
