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N-[8-(2-Chlorophenyl)hydrazono-5,6,7,8-tetrahydro-2-oxo-2H-1-benzopyran-3-yl]benzamide
SpectraBase Compound ID Dhsru9XrQBv
InChI InChI=1S/C22H18ClN3O3/c23-16-10-4-5-11-17(16)25-26-18-12-6-9-15-13-19(22(28)29-20(15)18)24-21(27)14-7-2-1-3-8-14/h1-5,7-8,10-11,13,25H,6,9,12H2,(H,24,27)/b26-18+
InChIKey OGFOULDXFOGFEH-NLRVBDNBSA-N
Mol Weight 407.86 g/mol
Molecular Formula C22H18ClN3O3
Exact Mass 407.103669 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D2srMGztHDg
Name N-[8-(2-Chlorophenyl)hydrazono-5,6,7,8-tetrahydro-2-oxo-2H-1-benzopyran-3-yl]benzamide
Alternate Name(s) N-{(8E)-8-[(2-chlorophenyl)hydrazono]-2-oxo-5,6,7,8-tetrahydro-2H-chromen-3-yl}benzamide
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H18ClN3O3
InChI InChI=1S/C22H18ClN3O3/c23-16-10-4-5-11-17(16)25-26-18-12-6-9-15-13-19(22(28)29-20(15)18)24-21(27)14-7-2-1-3-8-14/h1-5,7-8,10-11,13,25H,6,9,12H2,(H,24,27)/b26-18+
InChIKey OGFOULDXFOGFEH-NLRVBDNBSA-N
Molecular Weight 407.857 g/mol
SMILES N(\N=C\1C2=C(C=C(C(O2)=O)NC(=O)c2ccccc2)CCC1)c1c(Cl)cccc1
SPLASH splash10-0a4i-0900800000-fcbaa2eaebf598d8c491
Source of Spectrum H1-53-1116-3
Wiley ID 817969