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4-[3-(benzyloxy-1-propynyl]-3-methoxy-3-cyclobutene-1,2-dione
SpectraBase Compound ID 1k829bVOICa
InChI InChI=1S/C15H12O4/c1-18-15-12(13(16)14(15)17)8-5-9-19-10-11-6-3-2-4-7-11/h2-4,6-7H,9-10H2,1H3
InChIKey YAOUPFQCGSUMLU-UHFFFAOYSA-N
Mol Weight 256.26 g/mol
Molecular Formula C15H12O4
Exact Mass 256.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DPX8B88QIBm
Name 4-[3-(benzyloxy-1-propynyl]-3-methoxy-3-cyclobutene-1,2-dione
CAS Registry Number 113976-85-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H12O4
InChI InChI=1S/C15H12O4/c1-18-15-12(13(16)14(15)17)8-5-9-19-10-11-6-3-2-4-7-11/h2-4,6-7H,9-10H2,1H3
InChIKey YAOUPFQCGSUMLU-UHFFFAOYSA-N
Molecular Weight 256.257 g/mol
SMILES C1(=C(OC)C(C1=O)=O)C#CCOCc1ccccc1
SPLASH splash10-00ou-9100000000-d80107a64584dd729a67
Source of Spectrum J-53-2481-3
Synonyms 3-[3-(benzyloxy)-1-propynyl]-4-methoxy-3-cyclobutene-1,2-dione
Wiley ID 1259830