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

*Links on SpectraBase are not permalinks.

Methyl 2-chloromethyl-13-formyl-2(Z)-tridecenoate

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

Methyl 2-chloromethyl-13-formyl-2(Z)-tridecenoate
SpectraBase Compound ID KLRxE4TN2Jj
InChI InChI=1S/C16H27ClO3/c1-20-16(19)15(14-17)12-10-8-6-4-2-3-5-7-9-11-13-18/h12-13H,2-11,14H2,1H3/b15-12+
InChIKey DRFNOEIIMLUTMD-NTCAYCPXSA-N
Mol Weight 302.84 g/mol
Molecular Formula C16H27ClO3
Exact Mass 302.164872 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 AuNk5dIrT5t
Name Methyl 2-chloromethyl-13-formyl-2(Z)-tridecenoate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 302.164872426 u
Formula C16H27ClO3
InChI InChI=1S/C16H27ClO3/c1-20-16(19)15(14-17)12-10-8-6-4-2-3-5-7-9-11-13-18/h12-13H,2-11,14H2,1H3/b15-12+
InChIKey DRFNOEIIMLUTMD-NTCAYCPXSA-N
SMILES C(\C(=C\CCCCCCCCCCC=O)CCl)(=O)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.919239