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N-(1-adamantyl)-3-[(4-bromophenyl)sulfanyl]propanamide
SpectraBase Compound ID IZDAKnHRF3V
InChI InChI=1S/C19H24BrNOS/c20-16-1-3-17(4-2-16)23-6-5-18(22)21-19-10-13-7-14(11-19)9-15(8-13)12-19/h1-4,13-15H,5-12H2,(H,21,22)
InChIKey GXKRJDDJUBVKRR-UHFFFAOYSA-N
Mol Weight 394.37 g/mol
Molecular Formula C19H24BrNOS
Exact Mass 393.076199 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3b8vUOmkTHl
Name N-(1-Adamantyl)-3-[(4-bromophenyl)sulfanyl]propanamide
Alternate Name(s) N-(1-adamantyl)-3-[(4-bromophenyl)thio]propanamide N-(1-adamantyl)-3-[(4-bromophenyl)thio]propionamide Propanamide, N-(1-adamantyl)-3-(4-bromophenylthio)- N-(1-adamantyl)-3-(4-bromophenyl)sulfanylpropanamide
CAS Registry Number 309731-91-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H24BrNOS
InChI InChI=1S/C19H24BrNOS/c20-16-1-3-17(4-2-16)23-6-5-18(22)21-19-10-13-7-14(11-19)9-15(8-13)12-19/h1-4,13-15H,5-12H2,(H,21,22)
InChIKey GXKRJDDJUBVKRR-UHFFFAOYSA-N
Molecular Weight 394.371 g/mol
SMILES N(C12CC3CC(C2)CC(C1)C3)C(CCSc1ccc(cc1)Br)=O
SPLASH splash10-000i-8910000000-3d0c23f562a72965f719
Source of Spectrum AD-0-2532-0
Wiley ID 1429844