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Diethyl 2-[(2E)-2-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)ethylidene]malonate
SpectraBase Compound ID HIJLgZb8LU6
InChI InChI=1S/C17H19NO4S/c1-4-21-16(19)12(17(20)22-5-2)10-11-15-18(3)13-8-6-7-9-14(13)23-15/h6-11H,4-5H2,1-3H3/b15-11+
InChIKey FYZDXXZZKACZID-RVDMUPIBSA-N
Mol Weight 333.4 g/mol
Molecular Formula C17H19NO4S
Exact Mass 333.103479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EdzXlTPo9r5
Name Diethyl 2-[(2E)-2-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)ethylidene]malonate
CAS Registry Number 93407-84-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H19NO4S
InChI InChI=1S/C17H19NO4S/c1-4-21-16(19)12(17(20)22-5-2)10-11-15-18(3)13-8-6-7-9-14(13)23-15/h6-11H,4-5H2,1-3H3/b15-11+
InChIKey FYZDXXZZKACZID-RVDMUPIBSA-N
Molecular Weight 333.402 g/mol
SMILES c12N(\C(Sc1cccc2)=C/C=C(C(=O)OCC)C(=O)OCC)C
SPLASH splash10-000i-2942000000-c85af38cfc567d492d71
Source of Spectrum AD-0-2532-0
Synonyms 2-[(2E)-2-(3-methyl-1,3-benzothiazol-2-ylidene)ethylidene]malonic acid diethyl ester 2-[(2E)-2-(3-methyl-1,3-benzothiazol-2-ylidene)ethylidene]propanedioic acid diethyl ester Diethyl 2-[(2E)-2-(3-methyl-1,3-benzothiazol-2-ylidene)ethylidene]propanedioate Propanedioic acid, 2-(2,3-dihydro-3-methyl-2-benzothiazolylidene)ethylidene-, diethyl ester
Wiley ID 1432416