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Tetrazepam-M (HO-) isomer-1 AC
SpectraBase Compound ID 7C96LnWma9Y
InChI InChI=1S/C18H19ClN2O3/c1-11(22)24-14-6-3-12(4-7-14)18-15-9-13(19)5-8-16(15)21(2)17(23)10-20-18/h3,5,8-9,14H,4,6-7,10H2,1-2H3
InChIKey UMEUHMHHRQYIEP-UHFFFAOYSA-N
Mol Weight 346.81 g/mol
Molecular Formula C18H19ClN2O3
Exact Mass 346.10842 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4TB34DBFcTD
Name Tetrazepam-M (HO-) isomer-2 AC
Classification Muscle relaxant
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 346.108420177 u
Formula C18H19ClN2O3
InChI InChI=1S/C18H19ClN2O3/c1-11(22)24-14-6-3-12(4-7-14)18-15-9-13(19)5-8-16(15)21(2)17(23)10-20-18/h3,5,8-9,14H,4,6-7,10H2,1-2H3
InChIKey UMEUHMHHRQYIEP-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 346.814 g/mol
SMILES C1(=CCC(OC(C)=O)CC1)C=1c2cc(ccc2N(C(CN1)=O)C)Cl
SPLASH splash10-000i-2491000000-9049196873c2402a497a
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: UGLUCAC
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_620