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2-(Alloxycarbonyl)-1-benzyl-4-[(chloromethyl)methylene]-3-pyrazolidinecarboxylic acid methyl ester
SpectraBase Compound ID BPvYbGG1zGf
InChI InChI=1S/C18H21ClN2O4/c1-3-11-25-18(23)21-16(17(22)24-2)15(9-10-19)13-20(21)12-14-7-5-4-6-8-14/h3-9,16H,1,10-13H2,2H3/b15-9+
InChIKey IJLJYCJERXNBFQ-OQLLNIDSSA-N
Mol Weight 364.83 g/mol
Molecular Formula C18H21ClN2O4
Exact Mass 364.118985 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Nj8KxzYLSO
Name 2-(Alloxycarbonyl)-1-benzyl-4-[(chloromethyl)methylene]-3-pyrazolidinecarboxylic acid methyl ester
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21ClN2O4
InChI InChI=1S/C18H21ClN2O4/c1-3-11-25-18(23)21-16(17(22)24-2)15(9-10-19)13-20(21)12-14-7-5-4-6-8-14/h3-9,16H,1,10-13H2,2H3/b15-9+
InChIKey IJLJYCJERXNBFQ-OQLLNIDSSA-N
Molecular Weight 364.829 g/mol
SMILES C1N(N(C(\C1=C/CCl)C(=O)OC)C(=O)OCC=C)Cc1ccccc1
SPLASH splash10-0006-9134000000-4551f9f193385221f95c
Source of Spectrum F-49-8621-42
Synonyms 1-Allyl 5-methyl (4E)-2-benzyl-4-(2-chloroethylidene)-1,5-pyrazolidinedicarboxylate
Wiley ID 788301