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2-Isopropyloxy-3-methyl-4-hydroxy-4-pentynyl-2-cyclobuten-1-one
SpectraBase Compound ID ENMuAlAbU3d
InChI InChI=1S/C13H18O3/c1-5-6-7-8-13(15)10(4)11(12(13)14)16-9(2)3/h9,15H,5-6H2,1-4H3
InChIKey ZUBJGVLMCAZBDP-UHFFFAOYSA-N
Mol Weight 222.28 g/mol
Molecular Formula C13H18O3
Exact Mass 222.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4KTHpXnCpTY
Name 2-Isopropyloxy-3-methyl-4-hydroxy-4-pentynyl-2-cyclobuten-1-one
Alternate Name(s) 4-Hydroxy-2-isopropoxy-3-methyl-4-(1-pentynyl)-2-cyclobuten-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O3
InChI InChI=1S/C13H18O3/c1-5-6-7-8-13(15)10(4)11(12(13)14)16-9(2)3/h9,15H,5-6H2,1-4H3
InChIKey ZUBJGVLMCAZBDP-UHFFFAOYSA-N
Molecular Weight 222.284 g/mol
SMILES OC1(C(C(=C1C)OC(C)C)=O)C#CCCC
SPLASH splash10-001i-0910000000-7ea0b2fb2f568f7ac816
Source of Spectrum KC-57-5103-1
Wiley ID 1624563