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Allylescaline
SpectraBase Compound ID 7i3kLqCCfcE
InChI InChI=1S/C13H19NO3/c1-4-7-17-13-11(15-2)8-10(5-6-14)9-12(13)16-3/h4,8-9H,1,5-7,14H2,2-3H3
InChIKey JNUAYHHGCXYBHX-UHFFFAOYSA-N
Mol Weight 237.3 g/mol
Molecular Formula C13H19NO3
Exact Mass 237.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4H9kQccyYT0
Name Allylescaline
CAS Registry Number 39201-75-7
Classification Designer drug Stimulant
Copyright Copyright © 2023-2025 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 237.136493473 u
Formula C13H19NO3
InChI InChI=1S/C13H19NO3/c1-4-7-17-13-11(15-2)8-10(5-6-14)9-12(13)16-3/h4,8-9H,1,5-7,14H2,2-3H3
InChIKey JNUAYHHGCXYBHX-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 237.299 g/mol
SMILES c1(cc(cc(c1OCC=C)OC)CCN)OC
SPLASH splash10-014i-1910000000-b7aff7a8cf1a8920c034
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_10835