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N-formyl-3,4-methylenedioxyamphetamine

View entire compound with spectra: 1 NMR, 1 FTIR, and 5 MS (GC)

N-formyl-3,4-methylenedioxyamphetamine
SpectraBase Compound ID xn16ZhT1Qa
InChI InChI=1S/C11H13NO3/c1-8(12-6-13)4-9-2-3-10-11(5-9)15-7-14-10/h2-3,5-6,8H,4,7H2,1H3,(H,12,13)
InChIKey WGGJEXIHYZZZGU-UHFFFAOYSA-N
Mol Weight 207.23 g/mol
Molecular Formula C11H13NO3
Exact Mass 207.089543 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HGdCO70PEsJ
Name N-Formyl-3,4-methylenedioxyamphetamine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 207.089543280 u
Formula C11H13NO3
InChI InChI=1S/C11H13NO3/c1-8(12-6-13)4-9-2-3-10-11(5-9)15-7-14-10/h2-3,5-6,8H,4,7H2,1H3,(H,12,13)
InChIKey WGGJEXIHYZZZGU-UHFFFAOYSA-N
Molecular Weight 207.229 g/mol
SMILES C12=CC(=CC=C2OCO1)CC(C)NC=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.975432