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Methyl 4-(N-(4-methoxybenzyl)sulfamoyl)benzoate
SpectraBase Compound ID Lsv6y8lvBCi
InChI InChI=1S/C16H17NO5S/c1-21-14-7-3-12(4-8-14)11-17-23(19,20)15-9-5-13(6-10-15)16(18)22-2/h3-10,17H,11H2,1-2H3
InChIKey IZTUMVKUCBHLPR-UHFFFAOYSA-N
Mol Weight 335.37 g/mol
Molecular Formula C16H17NO5S
Exact Mass 335.082744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CqTRogchkZk
Name Methyl 4-(N-(4-methoxybenzyl)sulfamoyl)benzoate
Appearance Colorless solid
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Exact Mass 335.082743820 u
Formula C16H17NO5S
InChI InChI=1S/C16H17NO5S/c1-21-14-7-3-12(4-8-14)11-17-23(19,20)15-9-5-13(6-10-15)16(18)22-2/h3-10,17H,11H2,1-2H3
InChIKey IZTUMVKUCBHLPR-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201511385
Molecular Weight 335.374 g/mol
Quality 68
Reported Formula C16H17NO5(32)S
SMILES N(CC1=CC=C(C=C1)OC)S(C1=CC=C(C=C1)C(OC)=O)(=O)=O
SPLASH splash10-001i-0920000000-db6ffb95db01a3e85f53
Source of Spectrum ACI-55-SM47-S1 (DOI: 10.1002/anie.201511385)
Thin-Layer Chromatography 0.19 (cHex/EtOAc, 3:1)
Wiley ID 1895193