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(12R)-12-hydroxy-13-heptadecynoic acid
SpectraBase Compound ID EPvsyys5214
InChI InChI=1S/C17H30O3/c1-2-3-10-13-16(18)14-11-8-6-4-5-7-9-12-15-17(19)20/h16,18H,2-9,11-12,14-15H2,1H3,(H,19,20)/t16-/m0/s1
InChIKey XCGXPQNHMREHLR-INIZCTEOSA-N
Mol Weight 282.42 g/mol
Molecular Formula C17H30O3
Exact Mass 282.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J5lWwcXoVdp
Name (12R)-12-hydroxy-13-heptadecynoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H30O3
InChI InChI=1S/C17H30O3/c1-2-3-10-13-16(18)14-11-8-6-4-5-7-9-12-15-17(19)20/h16,18H,2-9,11-12,14-15H2,1H3,(H,19,20)/t16-/m0/s1
InChIKey XCGXPQNHMREHLR-INIZCTEOSA-N
Molecular Weight 282.424 g/mol
SMILES O[C@](CCCCCCCCCCC(=O)O)(C#CCCC)[H]
SPLASH splash10-0002-9300000000-1c21d9cb6c1cb768cf5f
Source of Spectrum E1-36-1422-7
Synonyms (12R)-12-hydroxyheptadec-13-ynoic acid (12R)-12-oxidanylheptadec-13-ynoic acid
Wiley ID 1574680