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2-Amino-4-(3-nitrophenyl)-4H-benzo[h]chromene-3-carbonitrile
SpectraBase Compound ID 6EMLeQWvxac
InChI InChI=1S/C20H13N3O3/c21-11-17-18(13-5-3-6-14(10-13)23(24)25)16-9-8-12-4-1-2-7-15(12)19(16)26-20(17)22/h1-10,18H,22H2
InChIKey KLHQWXOILCCTOX-UHFFFAOYSA-N
Mol Weight 343.34 g/mol
Molecular Formula C20H13N3O3
Exact Mass 343.095691 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DlEIomXtsQd
Name 2-Amino-4-(3-nitrophenyl)-4H-benzo[h]chromene-3-carbonitrile
Appearance Light yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 343.095691288 u
Formula C20H13N3O3
InChI InChI=1S/C20H13N3O3/c21-11-17-18(13-5-3-6-14(10-13)23(24)25)16-9-8-12-4-1-2-7-15(12)19(16)26-20(17)22/h1-10,18H,22H2
InChIKey KLHQWXOILCCTOX-UHFFFAOYSA-N
Instrument Name FISONS GC 8000/TRIO 1005
Ionization Type EI Positive ion
Literature Reference DOI 10.1002/jhet.4453
Molecular Weight 343.342 g/mol
Quality 850
SMILES NC=1OC2=C(C(C1C#N)C1=CC(=CC=C1)[N+](=O)[O-])C=CC1=C2C=CC=C1
SPLASH splash10-00di-9670000000-5c06e8e39a9b5f30606d
Source of Spectrum Y-59-SM20-4f (DOI: 10.1002/jhet.4453)
Wiley ID 1892474