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1-(2-Methoxy-3,4-methylenedioxyphenyl)butan-2-amine-A (CH2O,-H2O)
SpectraBase Compound ID 2Y9Ddyd005U
InChI InChI=1S/C13H17NO3/c1-4-10(14-2)7-9-5-6-11-13(12(9)15-3)17-8-16-11/h5-6,10H,2,4,7-8H2,1,3H3
InChIKey DCSRMFUGSSOUEF-UHFFFAOYSA-N
Mol Weight 235.28 g/mol
Molecular Formula C13H17NO3
Exact Mass 235.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Ir5j0TCtzk
Name 1-(2-Methoxy-3,4-methylenedioxyphenyl)butan-2-amine-A (CH2O,-H2O)
Classification Phenylbutanamine designer drug artifact
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 235.120843408 u
Formula C13H17NO3
InChI InChI=1S/C13H17NO3/c1-4-10(14-2)7-9-5-6-11-13(12(9)15-3)17-8-16-11/h5-6,10H,2,4,7-8H2,1,3H3
InChIKey DCSRMFUGSSOUEF-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 235.283 g/mol
Nominal Mass 235 u
Quality 992
Retention Index 1801
SMILES C12=C(C(=CC=C2OCO1)CC(N=C)CC)OC
SPLASH splash10-00xr-9410000000-4702f961f02518969204
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(1-(4-methoxy-1,3-benzodioxol-5-yl)butan-2-yl)methanimine
Technique GC/MS
Wiley ID DD2024_002013