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3-[1'(1'H)-(Phenylaminoacetyl)pyrazol-5'-yl]benzo[5,6]coumarin
SpectraBase Compound ID 9ezsrFsP5JD
InChI InChI=1S/C24H17N3O3/c28-23(15-25-17-7-2-1-3-8-17)27-21(12-13-26-27)20-14-19-18-9-5-4-6-16(18)10-11-22(19)30-24(20)29/h1-14,25H,15H2
InChIKey YPCTYHHCPOPXNF-UHFFFAOYSA-N
Mol Weight 395.42 g/mol
Molecular Formula C24H17N3O3
Exact Mass 395.126991 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6prEU0sGiec
Name 3-[1'(1'H)-(Phenylaminoacetyl)pyrazol-5'-yl]benzo[5,6]coumarin
Alternate Name(s) 2-(1-(2-(phenylamino)acetyl)-1H-pyrazol-5-yl)-3H-benzo[f]chromen-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H17N3O3
InChI InChI=1S/C24H17N3O3/c28-23(15-25-17-7-2-1-3-8-17)27-21(12-13-26-27)20-14-19-18-9-5-4-6-16(18)10-11-22(19)30-24(20)29/h1-14,25H,15H2
InChIKey YPCTYHHCPOPXNF-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cjoc.20020200709
Molecular Weight 395.418 g/mol
SMILES N(CC([n]1c(ccn1)C=1C(Oc2ccc3c(cccc3)c2C1)=O)=O)c1ccccc1
SPLASH splash10-004l-7109000000-ad373ccc4980a3f0a407
Source of Spectrum CJC-20-675-13a
Wiley ID 1773659