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2-(butan-2-ylamino)-3-chlorobenzoic acid methyl ester
SpectraBase Compound ID B6zSqdrEVe1
InChI InChI=1S/C12H16ClNO2/c1-4-8(2)14-11-9(12(15)16-3)6-5-7-10(11)13/h5-8,14H,4H2,1-3H3
InChIKey MSWDUNDPIWGIQA-UHFFFAOYSA-N
Mol Weight 241.72 g/mol
Molecular Formula C12H16ClNO2
Exact Mass 241.086956 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FNoed9SN429
Name 2-(butan-2-ylamino)-3-chlorobenzoic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16ClNO2
InChI InChI=1S/C12H16ClNO2/c1-4-8(2)14-11-9(12(15)16-3)6-5-7-10(11)13/h5-8,14H,4H2,1-3H3
InChIKey MSWDUNDPIWGIQA-UHFFFAOYSA-N
Molecular Weight 241.718 g/mol
SMILES N(c1c(C(=O)OC)cccc1Cl)C(CC)C
SPLASH splash10-01q9-0960000000-9dba676a39fb4c794718
Source of Spectrum KC-57-7691-4
Synonyms 3-Chloro-2-(sec-butylamino)benzoic acid methyl ester Methyl 2-(butan-2-ylamino)-3-chloranyl-benzoate Methyl 2-(butan-2-ylamino)-3-chlorobenzoate Methyl 3-chloro-2-(sec-butylamino)benzoate
Wiley ID 1625555