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(1r*,2R*,5S*)-2,5-dimethylcyclopentyl (E)-but-2-enoate
SpectraBase Compound ID blZYtUiMIA
InChI InChI=1S/C11H18O2/c1-4-5-10(12)13-11-8(2)6-7-9(11)3/h4-5,8-9,11H,6-7H2,1-3H3/b5-4+/t8-,9+,11+
InChIKey SROLIRSVDQCOJP-RCFZCHSMSA-N
Mol Weight 182.26 g/mol
Molecular Formula C11H18O2
Exact Mass 182.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AyowSJnESG8
Name (1r*,2R*,5S*)-2,5-dimethylcyclopentyl (E)-but-2-enoate
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O2
InChI InChI=1S/C11H18O2/c1-4-5-10(12)13-11-8(2)6-7-9(11)3/h4-5,8-9,11H,6-7H2,1-3H3/b5-4+/t8-,9+,11+
InChIKey SROLIRSVDQCOJP-RCFZCHSMSA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 182.263 g/mol
SMILES C(\C=C\C)(=O)O[C@]1([C@@](CC[C@@]1(C)[H])(C)[H])[H]
SPLASH splash10-014i-9000000000-56d4923fa22f24c7bd6e
Sample Comments dr = 20:74:6
Source of Spectrum WO2017139920A1
Wiley ID 1855468