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

*Links on SpectraBase are not permalinks.
1-(3,4-Methylenedioxyphenyl)but-1-ene
SpectraBase Compound ID 1yCz1FvIeNK
InChI InChI=1S/C11H12O2/c1-2-3-4-9-5-6-10-11(7-9)13-8-12-10/h3-7H,2,8H2,1H3/b4-3-
InChIKey ZLMZMSBNIVMXHF-ARJAWSKDSA-N
Mol Weight 176.21 g/mol
Molecular Formula C11H12O2
Exact Mass 176.08373 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 4CyEIZWcrY
Name 1-(3,4-Methylenedioxyphenyl)but-1-ene
Classification Designer drug precursor
Copyright Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 176.083729624 u
Formula C11H12O2
InChI InChI=1S/C11H12O2/c1-2-3-4-9-5-6-10-11(7-9)13-8-12-10/h3-7H,2,8H2,1H3/b4-3-
InChIKey ZLMZMSBNIVMXHF-ARJAWSKDSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 176.215 g/mol
Nominal Mass 176 u
Quality 990
Retention Index 1320
SMILES C1=2C(=CC=C(C2)\C=C/CC)OCO1
SPLASH splash10-0fc0-3900000000-c74ad0f4928fc88ccfe1
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 5-(but-1-en-1-yl)-1,3-benzodioxole
Technique GC/MS
Wiley ID DD2024_002217