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

*Links on SpectraBase are not permalinks.

3C-E ac

View entire compound with spectra: 1 NMR, 1 FTIR, and 2 MS (GC)

3C-E ac
SpectraBase Compound ID EUIIX5XwaM
InChI InChI=1S/C15H23NO4/c1-6-20-15-13(18-4)8-12(9-14(15)19-5)7-10(2)16-11(3)17/h8-10H,6-7H2,1-5H3,(H,16,17)
InChIKey XVRSVFKRJJSROC-UHFFFAOYSA-N
Mol Weight 281.35 g/mol
Molecular Formula C15H23NO4
Exact Mass 281.162708 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 21DWUvBbRh6
Name 3C-E ac
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 281.162708221 u
Formula C15H23NO4
InChI InChI=1S/C15H23NO4/c1-6-20-15-13(18-4)8-12(9-14(15)19-5)7-10(2)16-11(3)17/h8-10H,6-7H2,1-5H3,(H,16,17)
InChIKey XVRSVFKRJJSROC-UHFFFAOYSA-N
Molecular Weight 281.352 g/mol
SMILES C1(=C(C=C(C=C1OC)CC(NC(=O)C)C)OC)OCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.967872