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

*Links on SpectraBase are not permalinks.

3,9-Tetradecadienyl acetate

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

3,9-Tetradecadienyl acetate
SpectraBase Compound ID H7sCcY4PKo0
InChI InChI=1S/C16H28O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-16(2)17/h6-7,12-13H,3-5,8-11,14-15H2,1-2H3/b7-6+,13-12+
InChIKey NNEWUKBVQQTKJM-GYIPPJPDSA-N
Mol Weight 252.4 g/mol
Molecular Formula C16H28O2
Exact Mass 252.20893 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 KthwYHS8jMU
Name 3,9-Tetradecadienyl acetate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 252.208930140 u
Formula C16H28O2
InChI InChI=1S/C16H28O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-16(2)17/h6-7,12-13H,3-5,8-11,14-15H2,1-2H3/b7-6+,13-12+
InChIKey NNEWUKBVQQTKJM-GYIPPJPDSA-N
Molecular Weight 252.398 g/mol
SMILES C(=O)(OCC\C=C\CCCC\C=C\CCCC)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.938229