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2-[2-Chloro-1-propyl-4-(methoxycarbonyl)-5-methyl-1H-pyrrol-3-yl]acetic acid
SpectraBase Compound ID DR7kh7PAKUS
InChI InChI=1S/C12H16ClNO4/c1-4-5-14-7(2)10(12(17)18-3)8(11(14)13)6-9(15)16/h4-6H2,1-3H3,(H,15,16)
InChIKey GYVXLKNHIVWUHV-UHFFFAOYSA-N
Mol Weight 273.72 g/mol
Molecular Formula C12H16ClNO4
Exact Mass 273.076786 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EVjxRRAsKKC
Name 2-[2-Chloro-1-propyl-4-(methoxycarbonyl)-5-methyl-1H-pyrrol-3-yl]acetic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16ClNO4
InChI InChI=1S/C12H16ClNO4/c1-4-5-14-7(2)10(12(17)18-3)8(11(14)13)6-9(15)16/h4-6H2,1-3H3,(H,15,16)
InChIKey GYVXLKNHIVWUHV-UHFFFAOYSA-N
Molecular Weight 273.716 g/mol
SMILES OC(Cc1c(c([n](CCC)c1Cl)C)C(=O)OC)=O
SPLASH splash10-002f-9870000000-1116e13032bbbdb5df01
Source of Spectrum F-65-1706-3c
Wiley ID 1681777