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2-(4-nitrophenyl)-1,1-(8aH)-azulendicarbonitril
SpectraBase Compound ID Flco5NGtlpz
InChI InChI=1S/C18H11N3O2/c19-11-18(12-20)16-5-3-1-2-4-14(16)10-17(18)13-6-8-15(9-7-13)21(22)23/h1-10,16H
InChIKey CHNCHPMDEVTDML-UHFFFAOYSA-N
Mol Weight 301.31 g/mol
Molecular Formula C18H11N3O2
Exact Mass 301.085127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BYv4qktVX3R
Name 2-(4-nitrophenyl)-1,1-(8aH)-azulendicarbonitril
Alternate Name(s) 2-(4-nitrophenyl)-1,1(8aH)-azulenedicarbonitrile
CAS Registry Number 94111-20-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H11N3O2
InChI InChI=1S/C18H11N3O2/c19-11-18(12-20)16-5-3-1-2-4-14(16)10-17(18)13-6-8-15(9-7-13)21(22)23/h1-10,16H
InChIKey CHNCHPMDEVTDML-UHFFFAOYSA-N
Molecular Weight 301.305 g/mol
SMILES C1(C(=CC=2C1C=CC=CC2)c1ccc(N(=O)=O)cc1)(C#N)C#N
SPLASH splash10-0ufr-0093000000-e69ac0c9890f22d8a33c
Source of Spectrum K-119-2640-6
Wiley ID 1303909