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N,N-diisopropyl-3-(phenylsulfonyl)-3-(3-oxocyclopentyl)-2-methylenepropanamide
SpectraBase Compound ID kaXeZ2YoNZ
InChI InChI=1S/C21H29NO4S/c1-14(2)22(15(3)4)21(24)16(5)20(17-11-12-18(23)13-17)27(25,26)19-9-7-6-8-10-19/h6-10,14-15,17,20H,5,11-13H2,1-4H3
InChIKey KMRRBLGDYULCHJ-UHFFFAOYSA-N
Mol Weight 391.53 g/mol
Molecular Formula C21H29NO4S
Exact Mass 391.18173 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6ROzYyqTXG8
Name N,N-diisopropyl-3-(phenylsulfonyl)-3-(3-oxocyclopentyl)-2-methylenepropanamide
Alternate Name(s) N,N-diisopropyl-2-[(3-oxocyclopentyl)(phenylsulfonyl)methyl]acrylamide
CAS Registry Number 119039-08-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H29NO4S
InChI InChI=1S/C21H29NO4S/c1-14(2)22(15(3)4)21(24)16(5)20(17-11-12-18(23)13-17)27(25,26)19-9-7-6-8-10-19/h6-10,14-15,17,20H,5,11-13H2,1-4H3
InChIKey KMRRBLGDYULCHJ-UHFFFAOYSA-N
Molecular Weight 391.526 g/mol
SMILES C(C(N(C(C)C)C(C)C)=O)(C(S(=O)(=O)c1ccccc1)C1CC(=O)CC1)=C
SPLASH splash10-0udi-0290000000-5fb72f6c70b38f289162
Source of Spectrum J-54-1653-21
Wiley ID 1365343