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Hydroquinine
SpectraBase Compound ID KhclEiN99Ec
InChI InChI=1S/C20H26N2O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18/h4-6,8,11,13-14,19-20,23H,3,7,9-10,12H2,1-2H3/t13-,14-,19-,20+/m0/s1
InChIKey LJOQGZACKSYWCH-WZBLMQSHSA-N
Mol Weight 326.44 g/mol
Molecular Formula C20H26N2O2
Exact Mass 326.199428 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AeBPvAi4vj2
Name Hydroquinine
Copyright Copyright © 2012-2024 John Wiley & Sons, Inc. Portions provided by AAFS, Toxicology Section. All Rights Reserved.
Formula C20H26N2O2
InChI InChI=1S/C20H26N2O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18/h4-6,8,11,13-14,19-20,23H,3,7,9-10,12H2,1-2H3/t13-,14-,19-,20+/m0/s1
InChIKey LJOQGZACKSYWCH-WZBLMQSHSA-N
SMILES O[C@@]([C@]1(N2C[C@@]([C@](C1)(CC2)[H])(CC)[H])[H])(c1ccnc2c1cc(cc2)OC)[H]
SPLASH splash10-0bti-1910000000-2e0c3ee28cc25a9d6f4c
Source of Spectrum Mass Spectrometry Committee of the Toxicology Section of the American Academy of Forensic Sciences