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

*Links on SpectraBase are not permalinks.
Dyclonine-A
SpectraBase Compound ID zw2zIwVyTP
InChI InChI=1S/C13H16O2/c1-3-5-10-15-12-8-6-11(7-9-12)13(14)4-2/h4,6-9H,2-3,5,10H2,1H3
InChIKey CZBDUHWVJIGMRW-UHFFFAOYSA-N
Mol Weight 204.27 g/mol
Molecular Formula C13H16O2
Exact Mass 204.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID JI4yITPSTrc
Name Dyclonine-A
Classification Pharmaceutical drug artifact
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 204.115029753 u
Formula C13H16O2
InChI InChI=1S/C13H16O2/c1-3-5-10-15-12-8-6-11(7-9-12)13(14)4-2/h4,6-9H,2-3,5,10H2,1H3
InChIKey CZBDUHWVJIGMRW-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 204.269 g/mol
Nominal Mass 204 u
Quality 894
Retention Index 1479
SMILES C1(C(C=C)=O)=CC=C(C=C1)OCCCC
SPLASH splash10-00di-5910000000-6aa7713032c9279a2bb3
Sample Comments Structure uncertain
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-(4-n-Butoxyphenyl)-2-propen-1-one
Technique GC/MS
Wiley ID DD2024_014571