SpectraBase Spectrum ID |
CKvoPnFUlrk |
Name |
Atropine @ |
CAS Registry Number |
51-55-8 |
Classification |
Anticholinergic |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
289.167793602 u |
Formula |
C17H23NO3 |
InChI |
InChI=1S/C17H23NO3/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3/t13-,14+,15?,16? |
InChIKey |
RKUNBYITZUJHSG-PJPHBNEVSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
289.375 g/mol |
SMILES |
c1ccc(C(C(OC2C[C@@]3(N([C@](C2)(CC3)[H])C)[H])=O)CO)cc1 |
SPLASH |
splash10-00di-3910000000-12c7d5331287a6bfa5ee |
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: P G U |
Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
Synonyms |
Hyoscyamine |
Technique |
GC/MS |
Wiley ID |
MMPW6e_69 |