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1-Cyclopropanecarboxamide, 2-phenyl-N-octadecyl-
SpectraBase Compound ID KGdwgm1D0Bk
InChI InChI=1S/C28H47NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23-29-28(30)27-24-26(27)25-21-18-17-19-22-25/h17-19,21-22,26-27H,2-16,20,23-24H2,1H3,(H,29,30)
InChIKey QTVQYYOIYKQQJL-UHFFFAOYSA-N
Mol Weight 413.7 g/mol
Molecular Formula C28H47NO
Exact Mass 413.365765 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 4Jrud2qqrEd
Name 1-Cyclopropanecarboxamide, 2-phenyl-N-octadecyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 413.365765136 u
Formula C28H47NO
InChI InChI=1S/C28H47NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23-29-28(30)27-24-26(27)25-21-18-17-19-22-25/h17-19,21-22,26-27H,2-16,20,23-24H2,1H3,(H,29,30)
InChIKey QTVQYYOIYKQQJL-UHFFFAOYSA-N
Molecular Weight 413.690 g/mol
SMILES C(=O)(NCCCCCCCCCCCCCCCCCC)C1C(C1)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.847248