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1-(3,4-METHYLENEDIOXYPHENYL)-2-PYRROLIDINYLPENTAN-1-ONE;3,4-METHYLENEDIOXY-PYROVALERONE;MDPV
SpectraBase Compound ID GG7QOZWnMaD
InChI InChI=1S/C16H21NO3/c1-2-5-13(17-8-3-4-9-17)16(18)12-6-7-14-15(10-12)20-11-19-14/h6-7,10,13H,2-5,8-9,11H2,1H3
InChIKey SYHGEUNFJIGTRX-UHFFFAOYSA-N
Mol Weight 275.35 g/mol
Molecular Formula C16H21NO3
Exact Mass 275.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1DAdtpPnNvn
Name 1-(benzo[d][1,3]dioxol-5-yl)-2-(pyrrolidin-1-yl)pentan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21NO3
InChI InChI=1S/C16H21NO3/c1-2-5-13(17-8-3-4-9-17)16(18)12-6-7-14-15(10-12)20-11-19-14/h6-7,10,13H,2-5,8-9,11H2,1H3
InChIKey SYHGEUNFJIGTRX-UHFFFAOYSA-N
Molecular Weight 275.348 g/mol
SMILES c12c(ccc(c2)C(C(CCC)N2CCCC2)=O)OCO1
SPLASH splash10-004i-2900000000-884729f1ca5f93308920
Source of Spectrum Marcel Grapp, et al. Forensic Science International, 10.1016/j.forsciint.2017.01.021
Wiley ID 1816325