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(3S)-3-[(1E,3R)-3-Hydroxybut-1-en-1-yl]-2,2-dimethylcyclobutanone
SpectraBase Compound ID 9M0kwG8VtK2
InChI InChI=1S/C10H16O2/c1-7(11)4-5-8-6-9(12)10(8,2)3/h4-5,7-8,11H,6H2,1-3H3/b5-4+/t7-,8-/m1/s1
InChIKey NSIAWNYYOOBKDO-IVZJMYDKSA-N
Mol Weight 168.24 g/mol
Molecular Formula C10H16O2
Exact Mass 168.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5GEE2IOuJ3M
Name (3S)-3-[(1E,3R)-3-Hydroxybut-1-en-1-yl]-2,2-dimethylcyclobutanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O2
InChI InChI=1S/C10H16O2/c1-7(11)4-5-8-6-9(12)10(8,2)3/h4-5,7-8,11H,6H2,1-3H3/b5-4+/t7-,8-/m1/s1
InChIKey NSIAWNYYOOBKDO-IVZJMYDKSA-N
Literature Reference DOI 10.1002/cbdv.200890003
Molecular Weight 168.236 g/mol
SMILES O[C@@](\C=C\[C@@]1(CC(C1(C)C)=O)[H])(C)[H]
SPLASH splash10-0c03-9500000000-41ca98b7a5c3d8fcad2a
Source of Spectrum CBD-5-137-(S,R)_(E)_3
Synonyms (S)-3-((R,E)-3-hydroxybut-1-en-1-yl)-2,2-dimethylcyclobutan-1-one
Wiley ID 1788620