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Acepromazine-M (HO-dihydro-) 2AC
SpectraBase Compound ID AquNf3u8inT
InChI InChI=1S/C23H28N2O4S/c1-15(28-16(2)26)18-7-9-22-20(13-18)25(12-6-11-24(4)5)21-14-19(29-17(3)27)8-10-23(21)30-22/h7-10,13-15H,6,11-12H2,1-5H3
InChIKey JEBICAOHHMWBFC-UHFFFAOYSA-N
Mol Weight 428.55 g/mol
Molecular Formula C23H28N2O4S
Exact Mass 428.176979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Q0f7tSWMy
Name Acepromazine-M (HO-dihydro-) 2AC
Classification Sedative
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 428.176978560 u
Formula C23H28N2O4S
InChI InChI=1S/C23H28N2O4S/c1-15(28-16(2)26)18-7-9-22-20(13-18)25(12-6-11-24(4)5)21-14-19(29-17(3)27)8-10-23(21)30-22/h7-10,13-15H,6,11-12H2,1-5H3
InChIKey JEBICAOHHMWBFC-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 428.547 g/mol
SMILES c12c(N(CCCN(C)C)c3cc(ccc3S2)OC(C)=O)cc(C(C)OC(C)=O)cc1
SPLASH splash10-0a4i-9731000000-c615911d94a1d641bc0e
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: UHYAC
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_1308