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Scopolamine TMS
SpectraBase Compound ID CPmuFR6BC5d
InChI InChI=1S/C20H29NO4Si/c1-21-16-10-14(11-17(21)19-18(16)25-19)24-20(22)15(12-23-26(2,3)4)13-8-6-5-7-9-13/h5-9,14-19H,10-12H2,1-4H3/t14-,15?,16-,17+,18+,19-
InChIKey KYAGWQUTVDHVGQ-UFIUINBSSA-N
Mol Weight 375.54 g/mol
Molecular Formula C20H29NO4Si
Exact Mass 375.186585 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8H9z6sGpZz6
Name Scopolamine TMS
CAS Registry Number 55373-83-6
Classification Pharmaceutical drug derivative
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 375.186584949 u
Formula C20H29NO4Si
InChI InChI=1S/C20H29NO4Si/c1-21-16-10-14(11-17(21)19-18(16)25-19)24-20(22)15(12-23-26(2,3)4)13-8-6-5-7-9-13/h5-9,14-19H,10-12H2,1-4H3/t14-,15?,16-,17+,18+,19-
InChIKey KYAGWQUTVDHVGQ-UFIUINBSSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 375.540 g/mol
Nominal Mass 375 u
Quality 985
Retention Index 2401
SMILES [C@@]12([C@@]([C@]3(N([C@@]2(C[C@](C3)(OC(C(C=2C=CC=CC2)CO[Si](C)(C)C)=O)[H])[H])C)[H])(O1)[H])[H]
SPLASH splash10-000l-9800000000-00563f6a2fa5d4bbf95d
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 9-methyl-3-oxa-9-azatricyclo[3.3.1.0(2,4)]non-7-yl 2-phenyl-3-((trimethylsilyl)oxy)propanoate
Technique GC/MS
Wiley ID DD2024_023475