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2H-1,4-Benzoxazine-7-sulfonoyl chloride, 3,4-dihydro-6-methyl-3-oxo-
SpectraBase Compound ID CktXB8hd0Fw
InChI InChI=1S/C9H8ClNO4S/c1-5-2-6-7(15-4-9(12)11-6)3-8(5)16(10,13)14/h2-3H,4H2,1H3,(H,11,12)
InChIKey FBJMHTYNTPHUFM-UHFFFAOYSA-N
Mol Weight 261.68 g/mol
Molecular Formula C9H8ClNO4S
Exact Mass 260.986257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3cC6L4G5YG
Name 2H-1,4-Benzoxazine-7-sulfonoyl chloride, 3,4-dihydro-6-methyl-3-oxo-
Alternate Name(s) 6-Methyl-3-oxo-4H-1,4-benzoxazine-7-sulfonyl chloride 6-Methyl-3-oxidanylidene-4H-1,4-benzoxazine-7-sulfonyl chloride
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8ClNO4S
InChI InChI=1S/C9H8ClNO4S/c1-5-2-6-7(15-4-9(12)11-6)3-8(5)16(10,13)14/h2-3H,4H2,1H3,(H,11,12)
InChIKey FBJMHTYNTPHUFM-UHFFFAOYSA-N
Molecular Weight 261.679 g/mol
SMILES N1C(COc2cc(c(cc12)C)S(=O)(=O)Cl)=O
SPLASH splash10-03fr-7980000000-3029efc89fa5e030be99
Source of Spectrum IY-1-4367-4
Wiley ID 1651657