For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

N-(1-adamantylmethyl)-2-keto-8-methoxy-6-nitro-chromene-3-carboxamide

View entire compound with spectra: 1 NMR, and 1 MS (GC)

N-(1-adamantylmethyl)-2-keto-8-methoxy-6-nitro-chromene-3-carboxamide
SpectraBase Compound ID 6frL6fZNtQr
InChI InChI=1S/C22H24N2O6/c1-29-18-7-16(24(27)28)5-15-6-17(21(26)30-19(15)18)20(25)23-11-22-8-12-2-13(9-22)4-14(3-12)10-22/h5-7,12-14H,2-4,8-11H2,1H3,(H,23,25)
InChIKey VBVSWTNTQURHAB-UHFFFAOYSA-N
Mol Weight 412.44 g/mol
Molecular Formula C22H24N2O6
Exact Mass 412.163436 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 17W0PbYxmer
Name N-(1-Adamantylmethyl)-2-keto-8-methoxy-6-nitro-chromene-3-carboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 412.163436495 u
Formula C22H24N2O6
InChI InChI=1S/C22H24N2O6/c1-29-18-7-16(24(27)28)5-15-6-17(21(26)30-19(15)18)20(25)23-11-22-8-12-2-13(9-22)4-14(3-12)10-22/h5-7,12-14H,2-4,8-11H2,1H3,(H,23,25)
InChIKey VBVSWTNTQURHAB-UHFFFAOYSA-N
Molecular Weight 412.442 g/mol
SMILES C=1(C(OC2=C(C1)C=C(N(=O)=O)C=C2OC)=O)C(NCC12CC3CC(C2)CC(C1)C3)=O