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Benzoic acid, 2-[3,4-dihydro-2-(phenylmethyl)-2H-1,2,4-benzothiadiazin-3-yl]-, S,S-dioxide
SpectraBase Compound ID 8bbxX7NlxYa
InChI InChI=1S/C21H18N2O4S/c24-21(25)17-11-5-4-10-16(17)20-22-18-12-6-7-13-19(18)28(26,27)23(20)14-15-8-2-1-3-9-15/h1-13,20,22H,14H2,(H,24,25)
InChIKey BXLWHDQQZKVIHT-UHFFFAOYSA-N
Mol Weight 394.45 g/mol
Molecular Formula C21H18N2O4S
Exact Mass 394.098728 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F6TduGlhSBQ
Name Benzoic acid, 2-[3,4-dihydro-2-(phenylmethyl)-2H-1,2,4-benzothiadiazin-3-yl]-, S,S-dioxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18N2O4S
InChI InChI=1S/C21H18N2O4S/c24-21(25)17-11-5-4-10-16(17)20-22-18-12-6-7-13-19(18)28(26,27)23(20)14-15-8-2-1-3-9-15/h1-13,20,22H,14H2,(H,24,25)
InChIKey BXLWHDQQZKVIHT-UHFFFAOYSA-N
Molecular Weight 394.445 g/mol
SMILES N1c2c(S(N(C1c1c(C(=O)O)cccc1)Cc1ccccc1)(=O)=O)cccc2
SPLASH splash10-000f-9440000000-6a42d0a34f23ea0cf64f
Source of Spectrum IY-1-4666-2
Synonyms 2-[1,1-dioxo-2-(phenylmethyl)-3,4-dihydro-1$l^{6},2,4-benzothiadiazin-3-yl]benzoic acid 2-(2-benzyl-1,1-dioxo-3,4-dihydro-1$l^{6},2,4-benzothiadiazin-3-yl)benzoic acid 2-[1,1-bis(oxidanylidene)-2-(phenylmethyl)-3,4-dihydro-1$l^{6},2,4-benzothiadiazin-3-yl]benzoic acid
Wiley ID 1654645