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Dipivefrin -H2O
SpectraBase Compound ID 8hA5PpBwjxM
InChI InChI=1S/C19H27NO4/c1-18(2,3)16(21)23-14-9-8-13(10-11-20-7)12-15(14)24-17(22)19(4,5)6/h8-12,20H,1-7H3/b11-10+
InChIKey XUFJBUMQPSNTSZ-ZHACJKMWSA-N
Mol Weight 333.43 g/mol
Molecular Formula C19H27NO4
Exact Mass 333.194008 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HbvC6i0KmDi
Name Dipivefrin -H2O
Classification Sympathomimetic
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Exact Mass 333.194008349 u
Formula C19H27NO4
InChI InChI=1S/C19H27NO4/c1-18(2,3)16(21)23-14-9-8-13(10-11-20-7)12-15(14)24-17(22)19(4,5)6/h8-12,20H,1-7H3/b11-10+
InChIKey XUFJBUMQPSNTSZ-ZHACJKMWSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 333.428 g/mol
Related CAS Registry Number(s) 52365-63-6
SMILES c1cc(c(cc1\C=C\NC)OC(C(C)(C)C)=O)OC(=O)C(C)(C)C
SPLASH splash10-0a4i-9100000000-7cb545ca8d1fd6882e66
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.
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_2745