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Dronabinol-M (nor-delta-9-HOOC-glucuronide) MS3_2
SpectraBase Compound ID DqTvVqLa6uX
InChI InChI=1S/C21H26O3/c1-4-5-6-7-15-8-10-18(20(22)12-15)19-13-16(21(23)24)9-11-17(19)14(2)3/h8,12-13,17,19H,2,4-7,9,11H2,1,3H3,(H-,22,23,24)/p+1
InChIKey TZDZAAHMZLSJTE-UHFFFAOYSA-O
Mol Weight 327.44 g/mol
Molecular Formula C21H27O3
Exact Mass 327.19602 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID DVaZyf7EwKW
Name Tetrahydrocannabinol-M (nor-delta-9-HOOC-glucuronide) MS3_2
Comments T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [80.00-340.00]
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InChI InChI=1S/C21H26O3/c1-4-5-6-7-15-8-10-18(20(22)12-15)19-13-16(21(23)24)9-11-17(19)14(2)3/h8,12-13,17,19H,2,4-7,9,11H2,1,3H3,(H-,22,23,24)/p+1
InChIKey TZDZAAHMZLSJTE-UHFFFAOYSA-O
Ion Polarity P
Ionization Type ESI
SMILES OC(C=1CCC(C(C=2C(=CC(=C[C+]2)CCCCC)O)C1)C(=C)C)=O
Sample Comments The MWW Reference Handbook and associated table are attached to Record #1, under the Attachments tab. Refer to these references for the sample preparation procedure and abbreviations, as well as other relevant information pertaining to this database.
Sample Description Analyte Type: Metabolite
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Spectrum Type ms3
Technique ITMS