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Levomepromazine-M 3AC
SpectraBase Compound ID 6Vca8Tjo2VD
InChI InChI=1S/C23H26N2O5S/c1-14(12-24(5)15(2)26)13-25-20-10-18(29-16(3)27)6-8-22(20)31-23-9-7-19(11-21(23)25)30-17(4)28/h6-11,14H,12-13H2,1-5H3
InChIKey AUMDTLPSXOHMIS-UHFFFAOYSA-N
Mol Weight 442.53 g/mol
Molecular Formula C23H26N2O5S
Exact Mass 442.156243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID P1p6067l1W
Name Levomepromazine-M 3AC
Classification Neuroleptic
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 442.156243114 u
Formula C23H26N2O5S
InChI InChI=1S/C23H26N2O5S/c1-14(12-24(5)15(2)26)13-25-20-10-18(29-16(3)27)6-8-22(20)31-23-9-7-19(11-21(23)25)30-17(4)28/h6-11,14H,12-13H2,1-5H3
InChIKey AUMDTLPSXOHMIS-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 442.530 g/mol
SMILES c12c(N(CC(CN(C(C)=O)C)C)c3cc(OC(=O)C)ccc3S1)cc(cc2)OC(C)=O
SPLASH splash10-004i-3941100000-ca456a50d437afcd136f
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: U+UHYAC
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms Levomepromazine-M (N,O-bis-demethyl-HO-) 3AC
Technique GC/MS
Wiley ID MMPW6e_8519