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3-Chloranyl-4-(2,5-dimethoxyphenyl)-2-methoxy-cyclobut-2-en-1-one
SpectraBase Compound ID 8TfvwXXdMiN
InChI InChI=1S/C13H13ClO4/c1-16-7-4-5-9(17-2)8(6-7)10-11(14)13(18-3)12(10)15/h4-6,10H,1-3H3
InChIKey CBXAGIBRNCKVAF-UHFFFAOYSA-N
Mol Weight 268.7 g/mol
Molecular Formula C13H13ClO4
Exact Mass 268.050237 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4emA5caUi7e
Name 3-Chloranyl-4-(2,5-dimethoxyphenyl)-2-methoxy-cyclobut-2-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13ClO4
InChI InChI=1S/C13H13ClO4/c1-16-7-4-5-9(17-2)8(6-7)10-11(14)13(18-3)12(10)15/h4-6,10H,1-3H3
InChIKey CBXAGIBRNCKVAF-UHFFFAOYSA-N
Molecular Weight 268.696 g/mol
SMILES C1(C(Cl)=C(C1=O)OC)c1c(ccc(c1)OC)OC
SPLASH splash10-03km-0290000000-31860d2c0b4bf58f90fe
Source of Spectrum J-61-2091-11
Synonyms 3-Chloro-4-(2,5-dimethoxyphenyl)-2-methoxy-1-cyclobut-2-enone 3-Chloro-4-(2,5-dimethoxyphenyl)-2-methoxy-cyclobut-2-en-1-one
Wiley ID 1271806