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2-Amino-4-(4-hydroxy-3-methoxyphenyl)-4H-benzo[h]chromene-3-carbonitrile
SpectraBase Compound ID AipI5mCEWMj
InChI InChI=1S/C21H16N2O3/c1-25-18-10-13(7-9-17(18)24)19-15-8-6-12-4-2-3-5-14(12)20(15)26-21(23)16(19)11-22/h2-10,19,24H,23H2,1H3
InChIKey UOMYUIVWFJEXAV-UHFFFAOYSA-N
Mol Weight 344.37 g/mol
Molecular Formula C21H16N2O3
Exact Mass 344.116092 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ef81bxgWLin
Name 2-Amino-4-(4-hydroxy-3-methoxyphenyl)-4H-benzo[h]chromene-3-carbonitrile
Appearance Light yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 344.116092380 u
Formula C21H16N2O3
InChI InChI=1S/C21H16N2O3/c1-25-18-10-13(7-9-17(18)24)19-15-8-6-12-4-2-3-5-14(12)20(15)26-21(23)16(19)11-22/h2-10,19,24H,23H2,1H3
InChIKey UOMYUIVWFJEXAV-UHFFFAOYSA-N
Instrument Name FISONS GC 8000/TRIO 1008
Ionization Type EI Positive ion
Literature Reference DOI 10.1002/jhet.4453
Quality 1000
SMILES NC=1OC2=C(C(C3=CC(=C(C=C3)O)OC)C1C#N)C=CC1=C2C=CC=C1
SPLASH splash10-0ufu-9210000000-e69af1ad7c5401b12eba
Source of Spectrum Y-59-SM29-4l (DOI: 10.1002/jhet.4453)
Wiley ID 1892477