SpectraBase Spectrum ID |
IhS67qyB1TM |
Name |
1-Cyclopropanecarboxamide, 2-phenyl-N-2-ethylhexyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
273.209264492 u |
Formula |
C18H27NO |
InChI |
InChI=1S/C18H27NO/c1-3-5-9-14(4-2)13-19-18(20)17-12-16(17)15-10-7-6-8-11-15/h6-8,10-11,14,16-17H,3-5,9,12-13H2,1-2H3,(H,19,20) |
InChIKey |
XEKUCLNMSCRIHJ-UHFFFAOYSA-N |
Molecular Weight |
273.420 g/mol |
SMILES |
C(=O)(NCC(CCCC)CC)C1C(C1)C1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.931303 |