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1-(4-Fluorophenyl)-2-(4-allylpiperazin-1-yl)propan-1-one
SpectraBase Compound ID 1Rruz77XQ3Z
InChI InChI=1S/C16H21FN2O/c1-3-8-18-9-11-19(12-10-18)13(2)16(20)14-4-6-15(17)7-5-14/h3-7,13H,1,8-12H2,2H3
InChIKey KOMQTWKZRCMUEO-UHFFFAOYSA-N
Mol Weight 276.36 g/mol
Molecular Formula C16H21FN2O
Exact Mass 276.163791 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8I5L2Q4xtjM
Name 1-(4-Fluorophenyl)-2-(4-allylpiperazin-1-yl)propan-1-one
Classification Cathinone analog designer drug
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 276.163791466 u
Formula C16H21FN2O
InChI InChI=1S/C16H21FN2O/c1-3-8-18-9-11-19(12-10-18)13(2)16(20)14-4-6-15(17)7-5-14/h3-7,13H,1,8-12H2,2H3
InChIKey KOMQTWKZRCMUEO-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 276.355 g/mol
Nominal Mass 276 u
Quality 971
Retention Index 1950
SMILES C(N1CCN(CC1)CC=C)(C(C=1C=CC(=CC1)F)=O)C
SPLASH splash10-0udi-4900000000-7099389f1337dc40fee2
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-(4-fluorophenyl)-2-(4-(prop-2-en-1-yl)piperazin-1-yl)propan-1-one
Technique GC/MS
Wiley ID DD2024_012380