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Phenbutrazate
SpectraBase Compound ID 3Djp7YrUrr
InChI InChI=1S/C23H29NO3/c1-3-21(19-10-6-4-7-11-19)23(25)27-17-15-24-14-16-26-22(18(24)2)20-12-8-5-9-13-20/h4-13,18,21-22H,3,14-17H2,1-2H3
InChIKey BAQKJENAVQLANS-UHFFFAOYSA-N
Mol Weight 367.49 g/mol
Molecular Formula C23H29NO3
Exact Mass 367.214744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FnbLAdvZDTr
Name Fenbutrazate
CAS Registry Number 4378-36-3
Classification Anorectic
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Exact Mass 367.214743795 u
Formula C23H29NO3
InChI InChI=1S/C23H29NO3/c1-3-21(19-10-6-4-7-11-19)23(25)27-17-15-24-14-16-26-22(18(24)2)20-12-8-5-9-13-20/h4-13,18,21-22H,3,14-17H2,1-2H3
InChIKey BAQKJENAVQLANS-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 367.489 g/mol
SMILES C1OC(C(N(C1)CCOC(=O)C(c1ccccc1)CC)C)c1ccccc1
SPLASH splash10-014i-9410000000-091eaac7148958c300d9
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
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_773