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(4S,5R)-4-tert-butoxy-5-hydroxy-cyclopent-2-en-1-one
SpectraBase Compound ID Eiq82ZWJlsS
InChI InChI=1S/C9H14O3/c1-9(2,3)12-7-5-4-6(10)8(7)11/h4-5,7-8,11H,1-3H3/t7-,8-/m0/s1
InChIKey VEHNSQDRQWOJEU-YUMQZZPRSA-N
Mol Weight 170.21 g/mol
Molecular Formula C9H14O3
Exact Mass 170.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BMjr3opJ3Sf
Name (4S,5R)-4-tert-butoxy-5-hydroxy-cyclopent-2-en-1-one
CAS Registry Number 126566-41-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14O3
InChI InChI=1S/C9H14O3/c1-9(2,3)12-7-5-4-6(10)8(7)11/h4-5,7-8,11H,1-3H3/t7-,8-/m0/s1
InChIKey VEHNSQDRQWOJEU-YUMQZZPRSA-N
Molecular Weight 170.208 g/mol
SMILES O[C@@]1([C@](C=CC1=O)(OC(C)(C)C)[H])[H]
SPLASH splash10-06r2-9200000000-248e4b52f936707042e3
Source of Spectrum F-46-5141-2
Synonyms (4S,5R)-4-[(2-methylpropan-2-yl)oxy]-5-oxidanyl-cyclopent-2-en-1-one (4S,5R)-5-hydroxy-4-[(2-methylpropan-2-yl)oxy]-1-cyclopent-2-enone (4S,5R)-5-hydroxy-4-[(2-methylpropan-2-yl)oxy]cyclopent-2-en-1-one trans-4-t-butoxy-5-hydroxy-2-cyclopenten-1-one
Wiley ID 1166588