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Cocaine-M (HO-)
SpectraBase Compound ID BS0vWRyBqoC
InChI InChI=1S/C17H21NO5/c1-18-11-5-8-13(18)15(17(21)22-2)14(9-11)23-16(20)10-3-6-12(19)7-4-10/h3-4,6-7,11,13-15,19H,5,8-9H2,1-2H3
InChIKey RDFDJKYDYAUNDB-UHFFFAOYSA-N
Mol Weight 319.36 g/mol
Molecular Formula C17H21NO5
Exact Mass 319.141973 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4rFoqUy5MO
Name Cocaine-M (HO-)
Classification Local anesthetic Addictive drug
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 319.141972775 u
Formula C17H21NO5
InChI InChI=1S/C17H21NO5/c1-18-11-5-8-13(18)15(17(21)22-2)14(9-11)23-16(20)10-3-6-12(19)7-4-10/h3-4,6-7,11,13-15,19H,5,8-9H2,1-2H3
InChIKey RDFDJKYDYAUNDB-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 319.357 g/mol
SMILES c1(ccc(cc1)O)C(OC1C(C2N(C)C(CC2)C1)C(OC)=O)=O
SPLASH splash10-001i-9400000000-43ae583b40e8cff84e1f
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.
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_468