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4-tert-Butyl-3-ethoxy-4-hydroxy-1-cyclopent-2-enone
SpectraBase Compound ID A6pgzzfUgl0
InChI InChI=1S/C11H18O3/c1-5-14-9-6-8(12)7-11(9,13)10(2,3)4/h6,13H,5,7H2,1-4H3
InChIKey YHJAZUCVMFJXPN-UHFFFAOYSA-N
Mol Weight 198.26 g/mol
Molecular Formula C11H18O3
Exact Mass 198.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID yBMfMkWM6P
Name 4-tert-Butyl-3-ethoxy-4-hydroxy-1-cyclopent-2-enone
Alternate Name(s) 4-tert-Butyl-3-ethoxy-4-hydroxy-2-cyclopenten-1-one 4-tert-Butyl-3-ethoxy-4-hydroxy-cyclopent-2-en-1-one 4-tert-Butyl-3-ethoxy-4-oxidanyl-cyclopent-2-en-1-one
CAS Registry Number 115563-27-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O3
InChI InChI=1S/C11H18O3/c1-5-14-9-6-8(12)7-11(9,13)10(2,3)4/h6,13H,5,7H2,1-4H3
InChIKey YHJAZUCVMFJXPN-UHFFFAOYSA-N
Molecular Weight 198.262 g/mol
SMILES OC1(C(=CC(C1)=O)OCC)C(C)(C)C
SPLASH splash10-01ox-0900000000-08b56741152e1b81f99d
Source of Spectrum J-53-4715-29
Wiley ID 1195548