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4-Hydroxy-3-methoxy-2,4-di-1-pentynyl-2-cyclobuten-1-one

View entire compound with spectra: 1 MS (GC)

4-Hydroxy-3-methoxy-2,4-di-1-pentynyl-2-cyclobuten-1-one
SpectraBase Compound ID 9eqazXpxTHu
InChI InChI=1S/C15H18O3/c1-4-6-8-10-12-13(16)15(17,14(12)18-3)11-9-7-5-2/h17H,4-7H2,1-3H3
InChIKey BIHQWNOMHQMCLK-UHFFFAOYSA-N
Mol Weight 246.31 g/mol
Molecular Formula C15H18O3
Exact Mass 246.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EMP2vbuSHIa
Name 4-Hydroxy-3-methoxy-2,4-di-1-pentynyl-2-cyclobuten-1-one
CAS Registry Number 137395-13-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O3
InChI InChI=1S/C15H18O3/c1-4-6-8-10-12-13(16)15(17,14(12)18-3)11-9-7-5-2/h17H,4-7H2,1-3H3
InChIKey BIHQWNOMHQMCLK-UHFFFAOYSA-N
Molecular Weight 246.306 g/mol
SMILES OC1(C(OC)=C(C1=O)C#CCCC)C#CCCC
SPLASH splash10-0fvi-9300000000-3f20a04fe7a361162f45
Source of Spectrum J-57-337-0
Wiley ID 1249260