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Tolmetin-M (HOOC-) 2ME
SpectraBase Compound ID 252hxudct7d
InChI InChI=1S/C17H17NO5/c1-4-23-17(21)14-10-9-13(18(14)2)15(19)11-5-7-12(8-6-11)16(20)22-3/h5-10H,4H2,1-3H3
InChIKey AUJHQWLGDXBYHS-UHFFFAOYSA-N
Mol Weight 315.33 g/mol
Molecular Formula C17H17NO5
Exact Mass 315.110673 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JdcbCoWgkVm
Name Tolmetin-M (HOOC-) 2ME
Classification Antirheumatic
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 315.110672646 u
Formula C17H17NO5
InChI InChI=1S/C17H17NO5/c1-4-23-17(21)14-10-9-13(18(14)2)15(19)11-5-7-12(8-6-11)16(20)22-3/h5-10H,4H2,1-3H3
InChIKey AUJHQWLGDXBYHS-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 315.325 g/mol
SMILES c1(C(=O)c2ccc([n]2C)C(OCC)=O)ccc(C(=O)OC)cc1
SPLASH splash10-0a4i-2593000000-3e2913161e4462f9b888
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: UME
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_6298