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1-tert-Butyl-3-(4-chloranyl-3-methoxy-1-oxidanylidene-isochromen-7-yl)urea
SpectraBase Compound ID FwzuHmolG6d
InChI InChI=1S/C15H17ClN2O4/c1-15(2,3)18-14(20)17-8-5-6-9-10(7-8)12(19)22-13(21-4)11(9)16/h5-7H,1-4H3,(H2,17,18,20)
InChIKey ZZIVJTCIAKGZGY-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 8w68oSc6J5C
Name 1-tert-Butyl-3-(4-chloranyl-3-methoxy-1-oxidanylidene-isochromen-7-yl)urea
Alternate Name(s) 1-tert-Butyl-3-(4-chloro-1-keto-3-methoxy-isochromen-7-yl)urea 1-tert-Butyl-3-(4-chloro-3-methoxy-1-oxo-2-benzopyran-7-yl)urea 1-tert-Butyl-3-(4-chloro-3-methoxy-1-oxo-isochromen-7-yl)urea
CAS Registry Number 126062-29-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H17ClN2O4
InChI InChI=1S/C15H17ClN2O4/c1-15(2,3)18-14(20)17-8-5-6-9-10(7-8)12(19)22-13(21-4)11(9)16/h5-7H,1-4H3,(H2,17,18,20)
InChIKey ZZIVJTCIAKGZGY-UHFFFAOYSA-N
Molecular Weight 324.764 g/mol
SMILES N(C(NC(C)(C)C)=O)c1ccc2C(=C(OC(=O)c2c1)OC)Cl
SPLASH splash10-06ur-1691000000-f5cb698174dd189236b9
Source of Spectrum GT-1992-55-0
Wiley ID 1322931