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Ethyl 3-(bromomethyl)-2-([(4-methylphenyl)sulfonyl]amino)-4-pentenoate
SpectraBase Compound ID DRttyIlmpdX
InChI InChI=1S/C15H20BrNO4S/c1-4-12(10-16)14(15(18)21-5-2)17-22(19,20)13-8-6-11(3)7-9-13/h4,6-9,12,14,17H,1,5,10H2,2-3H3
InChIKey DOSQNYQHOYYRIR-UHFFFAOYSA-N
Mol Weight 390.29 g/mol
Molecular Formula C15H20BrNO4S
Exact Mass 389.029642 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DrnwcvwTeOO
Name Ethyl 3-(bromomethyl)-2-([(4-methylphenyl)sulfonyl]amino)-4-pentenoate
Alternate Name(s) 3-(bromomethyl)-2-(tosylamino)pent-4-enoic acid ethyl ester 3-(bromomethyl)-2-[(4-methylphenyl)sulfonylamino]-4-pentenoic acid ethyl ester 3-Bromomethyl-2-(toluene-4-sulfonylamino)-pent-4-enoic acid, ethyl ester Ethyl 3-(bromomethyl)-2-(p-tolylsulfonylamino)pent-4-enoate Ethyl 3-(bromomethyl)-2-[(4-methylphenyl)sulfonylamino]pent-4-enoate
CAS Registry Number 119027-72-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20BrNO4S
InChI InChI=1S/C15H20BrNO4S/c1-4-12(10-16)14(15(18)21-5-2)17-22(19,20)13-8-6-11(3)7-9-13/h4,6-9,12,14,17H,1,5,10H2,2-3H3
InChIKey DOSQNYQHOYYRIR-UHFFFAOYSA-N
Molecular Weight 390.292 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)C(C(CBr)C=C)C(=O)OCC
SPLASH splash10-0a4i-9330000000-a651b1d0a9c90c4651aa
Source of Spectrum H-71-1032-17
Wiley ID 1364247