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Phenyltoloxamine-M (HO-) isomer-1
SpectraBase Compound ID B3ey1qSW0Fx
InChI InChI=1S/C17H21NO2/c1-18(2)10-11-20-17-9-4-3-7-15(17)12-14-6-5-8-16(19)13-14/h3-9,13,19H,10-12H2,1-2H3
InChIKey YCDUZIOMGCXQAH-UHFFFAOYSA-N
Mol Weight 271.36 g/mol
Molecular Formula C17H21NO2
Exact Mass 271.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 13OIYZtSsgo
Name Phenyltoloxamine-M (HO-) isomer-1
Classification Antihistamine
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 271.157228918 u
Formula C17H21NO2
InChI InChI=1S/C17H21NO2/c1-18(2)10-11-20-17-9-4-3-7-15(17)12-14-6-5-8-16(19)13-14/h3-9,13,19H,10-12H2,1-2H3
InChIKey YCDUZIOMGCXQAH-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 271.360 g/mol
SMILES c1(Cc2cc(ccc2)O)ccccc1OCCN(C)C
SPLASH splash10-0a4i-9100000000-451a5afaa5274458cd91
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: UHY
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_1695