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(S)-4-Methylene-5-((Z)-2-penten-1-yl)-2-cyclopenten-1-one
SpectraBase Compound ID 304Afsw6sYh
InChI InChI=1S/C11H14O/c1-3-4-5-6-10-9(2)7-8-11(10)12/h4-5,7-8,10H,2-3,6H2,1H3/b5-4-/t10-/m0/s1
InChIKey PRLXPOSTWLLTTJ-LWTINBJPSA-N
Mol Weight 162.23 g/mol
Molecular Formula C11H14O
Exact Mass 162.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B981seVraRg
Name (S)-4-Methylene-5-((Z)-2-penten-1-yl)-2-cyclopenten-1-one
Appearance Yellowish liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14O
InChI InChI=1S/C11H14O/c1-3-4-5-6-10-9(2)7-8-11(10)12/h4-5,7-8,10H,2-3,6H2,1H3/b5-4-/t10-/m0/s1
InChIKey PRLXPOSTWLLTTJ-LWTINBJPSA-N
Instrument Name HP 6890/ MSD 5973 & HP 7890A/MSD 5975
Ionization Type EI
Literature Reference DOI 10.1021/acs.joc.1c00145
Molecular Weight 162.232 g/mol
Optical Rotation [a]D25 =-16.5 (c = 0.97, DCM)
SMILES C1(C=CC([C@]1(C\C=C/CC)[H])=O)=C
SPLASH splash10-0006-9300000000-49e0f18ff457b3ee174d
Sample Comments ee = 68
Source of Spectrum JOC-86-SM33-S-2
Wiley ID 1870197