| SpectraBase Spectrum ID |
FTFLamQQ04J |
| Name |
(11S)-(+)-Jalapinoic acid |
| Alternate Name(s) |
(11S)-11-hydroxyhexadecanoic acid
(11S)-11-oxidanylhexadecanoic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H32O3 |
| InChI |
InChI=1S/C16H32O3/c1-2-3-9-12-15(17)13-10-7-5-4-6-8-11-14-16(18)19/h15,17H,2-14H2,1H3,(H,18,19)/t15-/m0/s1 |
| InChIKey |
YNQGVRJFSHTULP-HNNXBMFYSA-N |
| Molecular Weight |
272.429 g/mol |
| SMILES |
OC(CCCCCCCCC[C@@](O)(CCCCC)[H])=O |
| SPLASH |
splash10-0006-9000000000-eb2c77f1f0f5aad94de5 |
| Source of Spectrum |
E1-44-1687-7 |
| Wiley ID |
1553541 |
