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Prolintane-M 3AC
SpectraBase Compound ID BiqPP0HaJpB
InChI InChI=1S/C21H27NO7/c1-5-18(27-13(2)23)17(22-10-6-7-21(22)26)11-16-8-9-19(28-14(3)24)20(12-16)29-15(4)25/h8-9,12,17-18H,5-7,10-11H2,1-4H3
InChIKey KLWSJQTUAXWYCV-UHFFFAOYSA-N
Mol Weight 405.45 g/mol
Molecular Formula C21H27NO7
Exact Mass 405.178752 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JHMxtSsNztR
Name Prolintane-M 3AC
Classification Stimulant
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 405.178752206 u
Formula C21H27NO7
InChI InChI=1S/C21H27NO7/c1-5-18(27-13(2)23)17(22-10-6-7-21(22)26)11-16-8-9-19(28-14(3)24)20(12-16)29-15(4)25/h8-9,12,17-18H,5-7,10-11H2,1-4H3
InChIKey KLWSJQTUAXWYCV-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 405.447 g/mol
SMILES CCC(C(N1C(=O)CCC1)Cc1cc(OC(=O)C)c(cc1)OC(=O)C)OC(=O)C
SPLASH splash10-0002-0920000000-6b493deeacebee6c6d6d
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
Synonyms Prolintane-M (oxo-tri-HO-) 3AC
Technique GC/MS
Wiley ID MMPW6e_4117