2-Chloranyl-N'-[(3,5-dimethyl-1-adamantyl)methyl]-N-(4-methylphenyl)sulfonyl-ethanimidamide

SpectraBase Compound ID	2FNAbTSZcHb
InChI	InChI=1S/C22H31ClN2O2S/c1-16-4-6-18(7-5-16)28(26,27)25-19(11-23)24-15-22-10-17-8-20(2,13-22)12-21(3,9-17)14-22/h4-7,17H,8-15H2,1-3H3,(H,24,25)/t17-,20+,21?,22-/m1/s1
InChIKey	ZZNLYNHUGPUZFK-GIZFZZLBSA-N Google Search
Mol Weight	423.02 g/mol
Molecular Formula	C22H31ClN2O2S
Exact Mass	422.179477 g/mol

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SpectraBase Spectrum ID	KblVR7EmEi7
Name	2-Chloranyl-N'-[(3,5-dimethyl-1-adamantyl)methyl]-N-(4-methylphenyl)sulfonyl-ethanimidamide
Alternate Name(s)	2-Chloro-N'-[(3,5-dimethyl-1-adamantyl)methyl]-N-(4-methylphenyl)sulfonylethanimidamide 2-Chloro-N'-[(3,5-dimethyl-1-adamantyl)methyl]-N-(p-tolylsulfonyl)acetamidine 2-Chloro-N'-[(3,5-dimethyl-1-adamantyl)methyl]-N-tosyl-acetamidine
CAS Registry Number	121721-50-4
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C22H31ClN2O2S
InChI	InChI=1S/C22H31ClN2O2S/c1-16-4-6-18(7-5-16)28(26,27)25-19(11-23)24-15-22-10-17-8-20(2,13-22)12-21(3,9-17)14-22/h4-7,17H,8-15H2,1-3H3,(H,24,25)/t17-,20+,21?,22-/m1/s1
InChIKey	ZZNLYNHUGPUZFK-GIZFZZLBSA-N
Molecular Weight	423.015 g/mol
SMILES	N(\C(=N\S(c1ccc(cc1)C)(=O)=O)CCl)C[C@]12CC3(C)C[C@@](C2)(C[C@](C1)(C3)C)[H]
SPLASH	splash10-07vi-0940000000-8ce10c100678e228b6f8
Source of Spectrum	Y-25-1854-0
Wiley ID	1378569