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Oxatomide
SpectraBase Compound ID LadjluYSUcq
InChI InChI=1S/C27H30N4O/c32-27-28-24-14-7-8-15-25(24)31(27)17-9-16-29-18-20-30(21-19-29)26(22-10-3-1-4-11-22)23-12-5-2-6-13-23/h1-8,10-15,26H,9,16-21H2,(H,28,32)
InChIKey BAINIUMDFURPJM-UHFFFAOYSA-N
Mol Weight 426.56 g/mol
Molecular Formula C27H30N4O
Exact Mass 426.241962 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C7y48xE0omk
Name Oxatomide
CAS Registry Number 60607-34-3
Classification Antihistamine
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 426.241961601 u
Formula C27H30N4O
InChI InChI=1S/C27H30N4O/c32-27-28-24-14-7-8-15-25(24)31(27)17-9-16-29-18-20-30(21-19-29)26(22-10-3-1-4-11-22)23-12-5-2-6-13-23/h1-8,10-15,26H,9,16-21H2,(H,28,32)
InChIKey BAINIUMDFURPJM-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 426.564 g/mol
SMILES C(c1ccccc1)(N1CCN(CC1)CCCN1c2ccccc2NC1=O)c1ccccc1
SPLASH splash10-016r-3930000000-4e459cde09effe64c3a6
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_1673