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7-i-propylcarbamoylamino-4-chloro-3-ethoxyisocoumarin
SpectraBase Compound ID F0hi9RIzBHx
InChI InChI=1S/C15H17ClN2O4/c1-4-21-14-12(16)10-6-5-9(7-11(10)13(19)22-14)18-15(20)17-8(2)3/h5-8H,4H2,1-3H3,(H2,17,18,20)
InChIKey VGDJHDYGQMRUEX-UHFFFAOYSA-N
Mol Weight 324.76 g/mol
Molecular Formula C15H17ClN2O4
Exact Mass 324.087685 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LLeb7CGdbCx
Name 7-i-propylcarbamoylamino-4-chloro-3-ethoxyisocoumarin
Alternate Name(s) N-(4-chloro-3-ethoxy-1-oxo-1H-2-benzopyran-7-yl)-N'-isopropylurea
CAS Registry Number 120218-94-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H17ClN2O4
InChI InChI=1S/C15H17ClN2O4/c1-4-21-14-12(16)10-6-5-9(7-11(10)13(19)22-14)18-15(20)17-8(2)3/h5-8H,4H2,1-3H3,(H2,17,18,20)
InChIKey VGDJHDYGQMRUEX-UHFFFAOYSA-N
Molecular Weight 324.764 g/mol
SMILES N(C(NC(C)C)=O)c1ccc2C(=C(OC(=O)c2c1)OCC)Cl
SPLASH splash10-03di-1891000000-b51081dfaec8cae8787e
Source of Spectrum GT-1992-58-0
Wiley ID 1322932