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 Google Search
Mol Weight	390.29 g/mol
Molecular Formula	C15H20BrNO4S
Exact Mass	389.029642 g/mol

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SpectraBase Spectrum ID	3EmhroVbiVH
Name	3-BROMOMETHYL-2-(TOLUENE-4-SULFONYLAMINO)PENT-4-ENOIC ACID, ETHYL ESTER
Copyright	Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula	C15H20NO4SBr
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	389.0291
SMILES	N(C(C(OCC)=O)C(C=C)CBr)S(=O)(=O)c1ccc(C)cc1
SPLASH	splash10-0a4i-9320000000-f9d982335a012bfcee45
Source of Spectrum	Chemical Concepts, A Wiley Division, Weinheim, Germany