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Adamantane-1-carboxamide, N-allyl-N-hexyl-

View entire compound with spectra: 1 NMR, and 1 FTIR

Adamantane-1-carboxamide, N-allyl-N-hexyl-
SpectraBase Compound ID CMlB8aVtkwK
InChI InChI=1S/C20H33NO/c1-3-5-6-7-9-21(8-4-2)19(22)20-13-16-10-17(14-20)12-18(11-16)15-20/h4,16-18H,2-3,5-15H2,1H3/t16-,17+,18-,20-
InChIKey YFMROBFDGMARHU-DSWCUTRASA-N
Mol Weight 303.5 g/mol
Molecular Formula C20H33NO
Exact Mass 303.256215 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3Z3PQyricgn
Name Adamantane-1-carboxamide, N-allyl-N-hexyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 303.256214686 u
Formula C20H33NO
InChI InChI=1S/C20H33NO/c1-3-5-6-7-9-21(8-4-2)19(22)20-13-16-10-17(14-20)12-18(11-16)15-20/h4,16-18H,2-3,5-15H2,1H3/t16-,17+,18-,20-
InChIKey YFMROBFDGMARHU-DSWCUTRASA-N
SMILES C12(C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H])C(N(CCCCCC)CC=C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.936624