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Fendiline-M (HO-) 2AC
SpectraBase Compound ID KuZsYYiOxuB
InChI InChI=1S/C27H29NO3/c1-20(23-10-6-4-7-11-23)28(21(2)29)19-18-27(24-12-8-5-9-13-24)25-14-16-26(17-15-25)31-22(3)30/h4-17,20,27H,18-19H2,1-3H3
InChIKey LYKREWXDUDIUNY-UHFFFAOYSA-N
Mol Weight 415.53 g/mol
Molecular Formula C27H29NO3
Exact Mass 415.214744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID kK1gsVvR4Z
Name Fendiline-M (HO-) 2AC
Classification Coronary dilator
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 415.214743795 u
Formula C27H29NO3
InChI InChI=1S/C27H29NO3/c1-20(23-10-6-4-7-11-23)28(21(2)29)19-18-27(24-12-8-5-9-13-24)25-14-16-26(17-15-25)31-22(3)30/h4-17,20,27H,18-19H2,1-3H3
InChIKey LYKREWXDUDIUNY-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 415.533 g/mol
SMILES c1c(ccc(OC(C)=O)c1)C(c1ccccc1)CCN(C(C)=O)C(C)c1ccccc1
SPLASH splash10-0ab9-4910100000-981158f1e76200b15c1d
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_3394