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Flavoxate
SpectraBase Compound ID 8EAKQwusUm
InChI InChI=1S/C24H25NO4/c1-17-21(26)19-11-8-12-20(23(19)29-22(17)18-9-4-2-5-10-18)24(27)28-16-15-25-13-6-3-7-14-25/h2,4-5,8-12H,3,6-7,13-16H2,1H3
InChIKey SPIUTQOUKAMGCX-UHFFFAOYSA-N
Mol Weight 391.47 g/mol
Molecular Formula C24H25NO4
Exact Mass 391.178358 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Aa0UbLChvjI
Name Fluvoxate
CAS Registry Number 15301-69-6
Classification Antispasmotic
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 391.178358285 u
Formula C24H25NO4
InChI InChI=1S/C24H25NO4/c1-17-21(26)19-11-8-12-20(23(19)29-22(17)18-9-4-2-5-10-18)24(27)28-16-15-25-13-6-3-7-14-25/h2,4-5,8-12H,3,6-7,13-16H2,1H3
InChIKey SPIUTQOUKAMGCX-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 391.467 g/mol
SMILES c12OC(c3ccccc3)=C(C(c1cccc2C(=O)OCCN1CCCCC1)=O)C
SPLASH splash10-0002-9500000000-b9e125007071db7d3daf
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
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_4520