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Methyl 2-(heptafluoropropyl)-8-methyl-4-(tosylamino)-4H-chromene-3-carboxylate
SpectraBase Compound ID Bu0cS8Am76g
InChI InChI=1S/C22H18F7NO5S/c1-11-7-9-13(10-8-11)36(32,33)30-16-14-6-4-5-12(2)17(14)35-18(15(16)19(31)34-3)20(23,24)21(25,26)22(27,28)29/h4-10,16,30H,1-3H3
InChIKey LWBRRMLXZLGZFU-UHFFFAOYSA-N
Mol Weight 541.44 g/mol
Molecular Formula C22H18F7NO5S
Exact Mass 541.079391 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1IloqW86uO
Name Methyl 2-(heptafluoropropyl)-8-methyl-4-(tosylamino)-4H-chromene-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H18F7NO5S
InChI InChI=1S/C22H18F7NO5S/c1-11-7-9-13(10-8-11)36(32,33)30-16-14-6-4-5-12(2)17(14)35-18(15(16)19(31)34-3)20(23,24)21(25,26)22(27,28)29/h4-10,16,30H,1-3H3
InChIKey LWBRRMLXZLGZFU-UHFFFAOYSA-N
Molecular Weight 541.437 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)C1C(=C(C(C(C(F)(F)F)(F)F)(F)F)Oc2c1cccc2C)C(=O)OC
SPLASH splash10-0079-0009000000-a77a4891ca551acedca1
Source of Spectrum F-65-9155-3f
Wiley ID 1678868