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2-[2-Chloro-1-isopropyl-4-(ethoxycarbonyl)-5-methyl-1H-pyrrol-3-yl]acetic acid
SpectraBase Compound ID 4lygrZdPbHv
InChI InChI=1S/C13H18ClNO4/c1-5-19-13(18)11-8(4)15(7(2)3)12(14)9(11)6-10(16)17/h7H,5-6H2,1-4H3,(H,16,17)
InChIKey XVBBIOLEIGYPDC-UHFFFAOYSA-N
Mol Weight 287.74 g/mol
Molecular Formula C13H18ClNO4
Exact Mass 287.092436 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KQBsNejJO73
Name 2-[2-Chloro-1-isopropyl-4-(ethoxycarbonyl)-5-methyl-1H-pyrrol-3-yl]acetic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18ClNO4
InChI InChI=1S/C13H18ClNO4/c1-5-19-13(18)11-8(4)15(7(2)3)12(14)9(11)6-10(16)17/h7H,5-6H2,1-4H3,(H,16,17)
InChIKey XVBBIOLEIGYPDC-UHFFFAOYSA-N
Molecular Weight 287.743 g/mol
SMILES OC(Cc1c(Cl)[n](c(c1C(=O)OCC)C)C(C)C)=O
SPLASH splash10-0006-9660000000-d9d80dec7d8b725b3bce
Source of Spectrum F-65-1706-3h
Wiley ID 1681772