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3-Cyano-4-methyl-2-oxo-2H-chromen-7-yl 2-nitrobenzenesulfonate
SpectraBase Compound ID W9JbYDmfNP
InChI InChI=1S/C17H10N2O7S/c1-10-12-7-6-11(8-15(12)25-17(20)13(10)9-18)26-27(23,24)16-5-3-2-4-14(16)19(21)22/h2-8H,1H3
InChIKey CSSVMSJTPLRVMF-UHFFFAOYSA-N
Mol Weight 386.33 g/mol
Molecular Formula C17H10N2O7S
Exact Mass 386.020872 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LQdU60cOXiB
Name 3-Cyano-4-methyl-2-oxo-2H-chromen-7-yl 2-nitrobenzenesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H10N2O7S
InChI InChI=1S/C17H10N2O7S/c1-10-12-7-6-11(8-15(12)25-17(20)13(10)9-18)26-27(23,24)16-5-3-2-4-14(16)19(21)22/h2-8H,1H3
InChIKey CSSVMSJTPLRVMF-UHFFFAOYSA-N
Molecular Weight 386.334 g/mol
SMILES c1(c(cccc1)[N+](=O)[O-])S(=O)(=O)Oc1ccc2C(=C(C(Oc2c1)=O)C#N)C
SPLASH splash10-0ukc-9520000000-f1c39f5fffa5f3c41dfb
Source of Spectrum Uzma Salar, et al. European Journal of Medicinal Chemistry, V.131, 2017, P.29-47
Wiley ID 1816416