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Phentolamine-A (N-desalkyl) 2AC
SpectraBase Compound ID 7pzM3WoFPY7
InChI InChI=1S/C17H17NO3/c1-12-7-9-15(10-8-12)18(13(2)19)16-5-4-6-17(11-16)21-14(3)20/h4-11H,1-3H3
InChIKey UPGHQDUMOBTVOB-UHFFFAOYSA-N
Mol Weight 283.33 g/mol
Molecular Formula C17H17NO3
Exact Mass 283.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JITHgZeg7bU
Name Phentolamine-A (N-desalkyl) 2AC
Classification Pharmaceutical drug, alpha-1-antagonist anti-hypertonic
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 283.120843408 u
Formula C17H17NO3
InChI InChI=1S/C17H17NO3/c1-12-7-9-15(10-8-12)18(13(2)19)16-5-4-6-17(11-16)21-14(3)20/h4-11H,1-3H3
InChIKey UPGHQDUMOBTVOB-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 283.327 g/mol
Nominal Mass 283 u
Quality 910
Retention Index 2160
SMILES C=1(N(C2=CC=C(C=C2)C)C(=O)C)C=C(C=CC1)OC(=O)C
SPLASH splash10-0002-0950000000-dc5d3babacc01dd1d306
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 3-(acetyl(4-methylphenyl)amino)phenyl acetate
Technique GC/MS
Wiley ID DD2024_003564