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2,3,4,5-TETRAHYDRO-5-METHYLSULFONYL-4-(4-METHOXYPHENYL)-1H-1,5-BENZODIAZEPIN-2-ONE

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2,3,4,5-TETRAHYDRO-5-METHYLSULFONYL-4-(4-METHOXYPHENYL)-1H-1,5-BENZODIAZEPIN-2-ONE
SpectraBase Compound ID 1bRDICMyD6t
InChI InChI=1S/C17H18N2O4S/c1-23-13-9-7-12(8-10-13)16-11-17(20)18-14-5-3-4-6-15(14)19(16)24(2,21)22/h3-10,16H,11H2,1-2H3,(H,18,20)
InChIKey RAKDNUKILGYFID-UHFFFAOYSA-N
Mol Weight 346.4 g/mol
Molecular Formula C17H18N2O4S
Exact Mass 346.098728 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4OJzTWJbvbZ
Name 4-(4-Methoxyphenyl)-5-methylsulfonyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one
Alternate Name(s) 5-Mesyl-4-(4-methoxyphenyl)-3,4-dihydro-1H-1,5-benzodiazepin-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18N2O4S
InChI InChI=1S/C17H18N2O4S/c1-23-13-9-7-12(8-10-13)16-11-17(20)18-14-5-3-4-6-15(14)19(16)24(2,21)22/h3-10,16H,11H2,1-2H3,(H,18,20)
InChIKey RAKDNUKILGYFID-UHFFFAOYSA-N
Molecular Weight 346.401 g/mol
SMILES N1C(CC(N(c2c1cccc2)S(=O)(=O)C)c1ccc(cc1)OC)=O
SPLASH splash10-00kr-0290000000-f1d5083f1b2997fd3378
Source of Spectrum KC-0-3481-3
Wiley ID 829682