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Acranil
SpectraBase Compound ID AOLjCQ0XQEZ
InChI InChI=1S/C21H26ClN3O2/c1-4-25(5-2)13-15(26)12-23-21-17-8-6-14(22)10-20(17)24-19-9-7-16(27-3)11-18(19)21/h6-11,15,26H,4-5,12-13H2,1-3H3,(H,23,24)
InChIKey UDDPPYHULIXFDV-UHFFFAOYSA-N
Mol Weight 387.91 g/mol
Molecular Formula C21H26ClN3O2
Exact Mass 387.171355 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JHnKuRV0gW8
Name Acranil
CAS Registry Number 522-20-3
Classification Pharmaceutical drug, chemotherapeutic
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 387.171354787 u
Formula C21H26ClN3O2
InChI InChI=1S/C21H26ClN3O2/c1-4-25(5-2)13-15(26)12-23-21-17-8-6-14(22)10-20(17)24-19-9-7-16(27-3)11-18(19)21/h6-11,15,26H,4-5,12-13H2,1-3H3,(H,23,24)
InChIKey UDDPPYHULIXFDV-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 387.911 g/mol
Nominal Mass 387 u
Quality 987
Retention Index 3067
SMILES OC(CNC1=C2C(=NC=3C1=CC=C(C3)Cl)C=CC(=C2)OC)CN(CC)CC
SPLASH splash10-000i-9110000000-9c0e1bc9e36635c4a564
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-[(6-Chloro-2-methoxy-acridin-9-yl)amino]-3-diethylamino-propan-2-ol
Technique GC/MS
Wiley ID DD2024_000053