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

*Links on SpectraBase are not permalinks.
Pentylone
SpectraBase Compound ID JXeQpIo8RPJ
InChI InChI=1S/C13H17NO3/c1-3-4-10(14-2)13(15)9-5-6-11-12(7-9)17-8-16-11/h5-7,10,14H,3-4,8H2,1-2H3
InChIKey DFMLULIEUUXXSA-UHFFFAOYSA-N
Mol Weight 235.28 g/mol
Molecular Formula C13H17NO3
Exact Mass 235.120843 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 AojTO72CtX8
Name Pentylone
Alternate Name(s) bk-MBDP bk-Methyl-K .beta.-keto-Methylbenzodioxolylpentanamine 1-(1,3-Benzodioxol-5-yl)-2-(methylamino)pentan-1-one 1-(benzo[d][1,3]dioxol-5-yl)-2-(methylamino)pentan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17NO3
InChI InChI=1S/C13H17NO3/c1-3-4-10(14-2)13(15)9-5-6-11-12(7-9)17-8-16-11/h5-7,10,14H,3-4,8H2,1-2H3
InChIKey DFMLULIEUUXXSA-UHFFFAOYSA-N
Molecular Weight 235.283 g/mol
SMILES N(C)C(C(=O)c1cc2c(cc1)OCO2)CCC
SPLASH splash10-000i-9000000000-d0dfb30de7d4d998b0a3
Source of Spectrum SWG-33-3756-0
Wiley ID 1810475