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2,6-Dibromo-4-(4-morpholinylcarbothioyl)phenyl acetate
SpectraBase Compound ID BlBGQcDMlHK
InChI InChI=1S/C13H13Br2NO3S/c1-8(17)19-12-10(14)6-9(7-11(12)15)13(20)16-2-4-18-5-3-16/h6-7H,2-5H2,1H3
InChIKey LUFHXOSJQMGNDT-UHFFFAOYSA-N
Mol Weight 423.12 g/mol
Molecular Formula C13H13Br2NO3S
Exact Mass 420.89829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J6zDqjFUMFn
Name 2,6-Dibromo-4-(4-morpholinylcarbothioyl)phenyl acetate
CAS Registry Number 294876-43-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13Br2NO3S
InChI InChI=1S/C13H13Br2NO3S/c1-8(17)19-12-10(14)6-9(7-11(12)15)13(20)16-2-4-18-5-3-16/h6-7H,2-5H2,1H3
InChIKey LUFHXOSJQMGNDT-UHFFFAOYSA-N
Molecular Weight 423.119 g/mol
SMILES C(c1cc(Br)c(c(c1)Br)OC(=O)C)(N1CCOCC1)=S
SPLASH splash10-0006-9100000000-33a367f26fef4c37f972
Source of Spectrum AD-0-2532-0
Synonyms Acetic acid, 2,6-dibromo-4-(4-morpholinylthiocarbonyl)phenyl ester Acetic acid [2,6-dibromo-4-[4-morpholinyl(sulfanylidene)methyl]phenyl] ester [2,6-dibromo-4-(morpholine-4-carbothioyl)phenyl] acetate [2,6-bis(bromanyl)-4-morpholin-4-ylcarbothioyl-phenyl] ethanoate
Wiley ID 1425638