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Methyl 4-methyl-3-(1-piperidinylsulfonyl)benzoate
SpectraBase Compound ID ACXwu9UAAF1
InChI InChI=1S/C14H19NO4S/c1-11-6-7-12(14(16)19-2)10-13(11)20(17,18)15-8-4-3-5-9-15/h6-7,10H,3-5,8-9H2,1-2H3
InChIKey HCHCWACJRUMOCP-UHFFFAOYSA-N
Mol Weight 297.37 g/mol
Molecular Formula C14H19NO4S
Exact Mass 297.103479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2zqFTYOGDQ
Name QMPSB-M/A (-COOH) ME
Classification Cannabinoid
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Exact Mass 297.103479266 u
Formula C14H19NO4S
InChI InChI=1S/C14H19NO4S/c1-11-6-7-12(14(16)19-2)10-13(11)20(17,18)15-8-4-3-5-9-15/h6-7,10H,3-5,8-9H2,1-2H3
InChIKey HCHCWACJRUMOCP-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 297.369 g/mol
SMILES c1cc(C(OC)=O)cc(c1C)S(=O)(N1CCCCC1)=O
SPLASH splash10-001j-9420000000-e690dc07473ce2d69972
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_10765