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Benzatropine
SpectraBase Compound ID ImPr3d3w62y
InChI InChI=1S/C21H25NO/c1-22-18-12-13-19(22)15-20(14-18)23-21(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-11,18-21H,12-15H2,1H3/t18-,19+,20?
InChIKey GIJXKZJWITVLHI-YOFSQIOKSA-N
Mol Weight 307.44 g/mol
Molecular Formula C21H25NO
Exact Mass 307.193614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C0F85roacXA
Name Benzatropine
CAS Registry Number 86-13-5
Classification Antiparkinsonian
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Exact Mass 307.193614428 u
Formula C21H25NO
InChI InChI=1S/C21H25NO/c1-22-18-12-13-19(22)15-20(14-18)23-21(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-11,18-21H,12-15H2,1H3/t18-,19+,20?
InChIKey GIJXKZJWITVLHI-YOFSQIOKSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 307.437 g/mol
SMILES CN1[C@]2(CC(OC(c3ccccc3)c3ccccc3)C[C@@]1(CC2)[H])[H]
SPLASH splash10-001i-9600000000-2506e010c7f69f7d298e
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: G 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_91