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Ethinamate
SpectraBase Compound ID 15Ib1352TwZ
InChI InChI=1S/C9H13NO2/c1-2-9(12-8(10)11)6-4-3-5-7-9/h1H,3-7H2,(H2,10,11)
InChIKey GXRZIMHKGDIBEW-UHFFFAOYSA-N
Mol Weight 167.21 g/mol
Molecular Formula C9H13NO2
Exact Mass 167.094629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4BqbSfJRYVc
Name Ethinamate
CAS Registry Number 126-52-3
Classification Hypnotic
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Exact Mass 167.094628661 u
Formula C9H13NO2
InChI InChI=1S/C9H13NO2/c1-2-9(12-8(10)11)6-4-3-5-7-9/h1H,3-7H2,(H2,10,11)
InChIKey GXRZIMHKGDIBEW-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 167.208 g/mol
SMILES C(OC1(C#C)CCCCC1)(N)=O
SPLASH splash10-0fsm-9200000000-88d1ad108dd56f130ccd
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Sample Preparation Procedure Detected: P G U
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_756