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1,3-Cyclopentanediol, 4-(2-hydroxyethyl)-5-(1-octenyl)-, [1R-[1.alpha.,3.beta.,4.alpha.,5.beta.(E)]]-
SpectraBase Compound ID AqjwFwSxVue
InChI InChI=1S/C15H28O3/c1-2-3-4-5-6-7-8-12-13(9-10-16)15(18)11-14(12)17/h7-8,12-18H,2-6,9-11H2,1H3/b8-7+/t12-,13-,14-,15-/m1/s1
InChIKey UOMXDBMUGJAEJX-IETUAJKLSA-N
Mol Weight 256.39 g/mol
Molecular Formula C15H28O3
Exact Mass 256.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1niWiPrua0
Name 1,3-Cyclopentanediol, 4-(2-hydroxyethyl)-5-(1-octenyl)-, [1R-[1.alpha.,3.beta.,4.alpha.,5.beta.(E)]]-
CAS Registry Number 61507-30-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H28O3
InChI InChI=1S/C15H28O3/c1-2-3-4-5-6-7-8-12-13(9-10-16)15(18)11-14(12)17/h7-8,12-18H,2-6,9-11H2,1H3/b8-7+/t12-,13-,14-,15-/m1/s1
InChIKey UOMXDBMUGJAEJX-IETUAJKLSA-N
Molecular Weight 256.386 g/mol
SMILES O[C@@]1(C[C@]([C@@]([C@]1(CCO)[H])(\C=C\CCCCCC)[H])(O)[H])[H]
SPLASH splash10-0536-9100000000-2baf1e77c8802efd9292
Source of Spectrum AN-85-518-0
Synonyms (1R,3R,4R,5R)-4-(2-hydroxyethyl)-5-[(1E)-1-octenyl]-1,3-cyclopentanediol 2-(2'-Hydroxyethyl)-3-(1'-octenyl)-1,4-cyclopentandiol
Wiley ID 1259958