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N-(2-Cyano-ethyl)-4-(3-methyl-1,4-dioxo-1,4,4a,8a-tetrahydronaphthalen-2-ylmethyl)-benzamide
SpectraBase Compound ID A6nd1L1dTM8
InChI InChI=1S/C22H18N2O3/c1-14-19(21(26)18-6-3-2-5-17(18)20(14)25)13-15-7-9-16(10-8-15)22(27)24-12-4-11-23/h2-3,5-10H,4,12-13H2,1H3,(H,24,27)
InChIKey NGRWYGFIAMDEEW-UHFFFAOYSA-N
Mol Weight 358.4 g/mol
Molecular Formula C22H18N2O3
Exact Mass 358.131742 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LQRMWmQaEzz
Name N-(2-Cyano-ethyl)-4-(3-methyl-1,4-dioxo-1,4,4a,8a-tetrahydronaphthalen-2-ylmethyl)-benzamide
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H18N2O3
InChI InChI=1S/C22H18N2O3/c1-14-19(21(26)18-6-3-2-5-17(18)20(14)25)13-15-7-9-16(10-8-15)22(27)24-12-4-11-23/h2-3,5-10H,4,12-13H2,1H3,(H,24,27)
InChIKey NGRWYGFIAMDEEW-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 358.397 g/mol
SMILES N(C(c1ccc(CC=2C(c3ccccc3C(C2C)=O)=O)cc1)=O)CCC#N
SPLASH splash10-0006-9035000000-77b6f16c3fa1b676de2e
Source of Spectrum US20110059972A1
Wiley ID 1861701