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Gabapentin lactam
SpectraBase Compound ID 9fQjPkG4s7N
InChI InChI=1S/C9H15NO/c11-8-6-9(7-10-8)4-2-1-3-5-9/h1-7H2,(H,10,11)
InChIKey JAWPQJDOQPSNIQ-UHFFFAOYSA-N
Mol Weight 153.22 g/mol
Molecular Formula C9H15NO
Exact Mass 153.115364 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A8Dn0NpSRIu
Name Gabapentin-A (-H2O)
CAS Registry Number 64744-50-9
Classification Pharmaceutical drug artifact
Comments Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 153.115364106 u
Formula C9H15NO
InChI InChI=1S/C9H15NO/c11-8-6-9(7-10-8)4-2-1-3-5-9/h1-7H2,(H,10,11)
InChIKey JAWPQJDOQPSNIQ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 153.225 g/mol
Nominal Mass 153 u
Quality 1000
Retention Index 1249
SMILES C12(CNC(C2)=O)CCCCC1
SPLASH splash10-0ue9-9500000000-28970d71ed78fcb2e1e3
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Gabapentin lactam 2-azaspiro[4.5]decan-3-one
Technique GC/MS
Wiley ID DD2024_025729