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N-(4-isopropylphenyl)-N-(coumarin-4-sulfonyl)urea
SpectraBase Compound ID DAYphkWJlGO
InChI InChI=1S/C19H18N2O5S/c1-12(2)13-7-9-14(10-8-13)20-19(23)21-27(24,25)17-11-18(22)26-16-6-4-3-5-15(16)17/h3-12H,1-2H3,(H2,20,21,23)
InChIKey XIBNWSHOMDNPRR-UHFFFAOYSA-N
Mol Weight 386.42 g/mol
Molecular Formula C19H18N2O5S
Exact Mass 386.093643 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5CRQH8ynR8l
Name N-(4-isopropylphenyl)-N-(coumarin-4-sulfonyl)urea
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 386.093642857 u
Formula C19H18N2O5S
InChI InChI=1S/C19H18N2O5S/c1-12(2)13-7-9-14(10-8-13)20-19(23)21-27(24,25)17-11-18(22)26-16-6-4-3-5-15(16)17/h3-12H,1-2H3,(H2,20,21,23)
InChIKey XIBNWSHOMDNPRR-UHFFFAOYSA-N
Instrument Name AEI MS 902 S
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0002.610
Molecular Weight 386.422 g/mol
Quality 63
SMILES N(S(C1=CC(OC2=C1C=CC=C2)=O)(=O)=O)C(NC1=CC=C(C=C1)C(C)C)=O
SPLASH splash10-00di-0900000000-25dd07b17db003d57b30
Source of Spectrum ARK-2001-107-9 (DOI: 10.3998/ark.5550190.0002.610)
Wiley ID 1908787