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6-Chloranyl-4-phenacyl-1,4-benzoxazin-3-one
SpectraBase Compound ID BkGMJvxIBRe
InChI InChI=1S/C16H12ClNO3/c17-12-6-7-15-13(8-12)18(16(20)10-21-15)9-14(19)11-4-2-1-3-5-11/h1-8H,9-10H2
InChIKey BMTXIMBHZUUACE-UHFFFAOYSA-N
Mol Weight 301.73 g/mol
Molecular Formula C16H12ClNO3
Exact Mass 301.050571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fzgl58iBl9B
Name 6-Chloranyl-4-phenacyl-1,4-benzoxazin-3-one
Alternate Name(s) 6-Chloro-4-phenacyl-1,4-benzoxazin-3-one
CAS Registry Number 105492-48-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12ClNO3
InChI InChI=1S/C16H12ClNO3/c17-12-6-7-15-13(8-12)18(16(20)10-21-15)9-14(19)11-4-2-1-3-5-11/h1-8H,9-10H2
InChIKey BMTXIMBHZUUACE-UHFFFAOYSA-N
Molecular Weight 301.729 g/mol
SMILES c12N(C(COc2ccc(c1)Cl)=O)CC(=O)c1ccccc1
SPLASH splash10-0a4i-0901000000-d01b0e7296f7f676d5af
Source of Spectrum O-24-512-8
Wiley ID 1303761