(2E)-7-{[(4-methylphenyl)sulfonyl]amino}hept-2-en-1-yl acetate

SpectraBase Compound ID	KCT0v3sF3h9
InChI	InChI=1S/C16H23NO4S/c1-14-8-10-16(11-9-14)22(19,20)17-12-6-4-3-5-7-13-21-15(2)18/h5,7-11,17H,3-4,6,12-13H2,1-2H3/b7-5+
InChIKey	GNBVJKALLXOARC-FNORWQNLSA-N Google Search
Mol Weight	325.42 g/mol
Molecular Formula	C16H23NO4S
Exact Mass	325.134779 g/mol

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SpectraBase Spectrum ID	8jf3utrneDh
Name	(2E)-7-{[(4-Methylphenyl)sulfonyl]amino}hept-2-en-1-yl acetate
Copyright	Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C16H23NO4S
InChI	InChI=1S/C16H23NO4S/c1-14-8-10-16(11-9-14)22(19,20)17-12-6-4-3-5-7-13-21-15(2)18/h5,7-11,17H,3-4,6,12-13H2,1-2H3/b7-5+
InChIKey	GNBVJKALLXOARC-FNORWQNLSA-N
Literature Reference DOI	10.1021/ol100422d
Molecular Weight	325.423 g/mol
SMILES	N(CCCC\C=C\COC(C)=O)S(c1ccc(cc1)C)(=O)=O
SPLASH	splash10-0006-9300000000-43cf3ed599ca34cb21a3
Source of Spectrum	A1-12-1808/SMS5-1e
Synonyms	(E)-7-(4-methylphenylsulfonamido)hept-2-en-1-yl acetate
Wiley ID	1752072