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ethyl 2-(butan-2-ylamino)-3-chlorobenzoate
SpectraBase Compound ID LEroB3Jjscf
InChI InChI=1S/C13H18ClNO2/c1-4-9(3)15-12-10(13(16)17-5-2)7-6-8-11(12)14/h6-9,15H,4-5H2,1-3H3
InChIKey IFQVJFFPBHBEMU-UHFFFAOYSA-N
Mol Weight 255.74 g/mol
Molecular Formula C13H18ClNO2
Exact Mass 255.102607 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4GEh9mGMrek
Name 2-(butan-2-ylamino)-3-chlorobenzoic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18ClNO2
InChI InChI=1S/C13H18ClNO2/c1-4-9(3)15-12-10(13(16)17-5-2)7-6-8-11(12)14/h6-9,15H,4-5H2,1-3H3
InChIKey IFQVJFFPBHBEMU-UHFFFAOYSA-N
Molecular Weight 255.745 g/mol
SMILES N(c1c(C(=O)OCC)cccc1Cl)C(CC)C
SPLASH splash10-001i-5960000000-c0690bb6a0c6cc5bde32
Source of Spectrum KC-57-7691-4
Synonyms 3-Chloro-2-(sec-butylamino)benzoic acid ethyl ester Ethyl 2-(butan-2-ylamino)-3-chloranyl-benzoate Ethyl 2-(butan-2-ylamino)-3-chlorobenzoate Ethyl 3-chloro-2-(sec-butylamino)benzoate
Wiley ID 1625552