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3-(3',3'-Dimethoxy-1'-chloroprop-1'-enyl)-coumarin
SpectraBase Compound ID EkRXeyzV19n
InChI InChI=1S/C14H13ClO4/c1-17-13(18-2)8-11(15)10-7-9-5-3-4-6-12(9)19-14(10)16/h3-8,13H,1-2H3/b11-8-
InChIKey MBPYWPZRQNOYGI-FLIBITNWSA-N
Mol Weight 280.71 g/mol
Molecular Formula C14H13ClO4
Exact Mass 280.050237 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ECnwlnCPbNQ
Name 3-(3',3'-Dimethoxy-1'-chloroprop-1'-enyl)-coumarin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H13ClO4
InChI InChI=1S/C14H13ClO4/c1-17-13(18-2)8-11(15)10-7-9-5-3-4-6-12(9)19-14(10)16/h3-8,13H,1-2H3/b11-8-
InChIKey MBPYWPZRQNOYGI-FLIBITNWSA-N
Molecular Weight 280.707 g/mol
SMILES C=1(C(Oc2c(C1)cccc2)=O)\C(=C\C(OC)OC)Cl
SPLASH splash10-0002-1290000000-094f9f6efce17594f6b3
Source of Spectrum Y5-63-369-4
Synonyms 3-[(1Z)-1-chloro-3,3-dimethoxy-1-propenyl]-2H-chromen-2-one
Wiley ID 879355