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3-Chloro-N-tosyl-1,4-benzoxazine-2-carbaldehyde
SpectraBase Compound ID 319YunNYtqO
InChI InChI=1S/C16H12ClNO4S/c1-11-6-8-12(9-7-11)23(20,21)18-13-4-2-3-5-14(13)22-15(10-19)16(18)17/h2-10H,1H3
InChIKey LIMUIBNWSMFRHH-UHFFFAOYSA-N
Mol Weight 349.79 g/mol
Molecular Formula C16H12ClNO4S
Exact Mass 349.017557 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1mQa7HtO4hc
Name 3-Chloro-N-tosyl-1,4-benzoxazine-2-carbaldehyde
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12ClNO4S
InChI InChI=1S/C16H12ClNO4S/c1-11-6-8-12(9-7-11)23(20,21)18-13-4-2-3-5-14(13)22-15(10-19)16(18)17/h2-10H,1H3
InChIKey LIMUIBNWSMFRHH-UHFFFAOYSA-N
Molecular Weight 349.788 g/mol
SMILES C=1(Oc2c(N(C1Cl)S(=O)(=O)c1ccc(C)cc1)cccc2)C=O
SPLASH splash10-0561-6907000000-95e8732d0b54b4a4e6e5
Source of Spectrum Y1-37-40-2
Synonyms 3-Chloro-4-[(4-methylphenyl)sulfonyl]-4H-1,4-benzoxazine-2-carbaldehyde
Wiley ID 1527281