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Phenibut-A (-H2O) BUT
SpectraBase Compound ID BR7XCHVBMSR
InChI InChI=1S/C14H17NO2/c1-2-6-13(16)15-10-12(9-14(15)17)11-7-4-3-5-8-11/h3-5,7-8,12H,2,6,9-10H2,1H3
InChIKey LPUDKBVOISCCMU-UHFFFAOYSA-N
Mol Weight 231.29 g/mol
Molecular Formula C14H17NO2
Exact Mass 231.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GUyjCQBEUfQ
Name Phenibut-A (-H2O) BUT
Classification Pharmaceutical drug artifact derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 231.125928789 u
Formula C14H17NO2
InChI InChI=1S/C14H17NO2/c1-2-6-13(16)15-10-12(9-14(15)17)11-7-4-3-5-8-11/h3-5,7-8,12H,2,6,9-10H2,1H3
InChIKey LPUDKBVOISCCMU-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 231.295 g/mol
Nominal Mass 231 u
Quality 994
Retention Index 1935
SMILES C1(C2=CC=CC=C2)CN(C(C1)=O)C(CCC)=O
SPLASH splash10-0uxr-4930000000-f6fe7646a02842c97ef9
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-butanoyl-4-phenylpyrrolidin-2-one
Technique GC/MS
Wiley ID DD2024_012413