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Aspidospermidin-17-ol, 1-acetyl-
SpectraBase Compound ID 5rwd7ec64a2
InChI InChI=1S/C21H28N2O2/c1-3-20-9-5-12-22-13-11-21(19(20)22)15-6-4-7-16(25)18(15)23(14(2)24)17(21)8-10-20/h4,6-7,17,19,25H,3,5,8-13H2,1-2H3
InChIKey XLNXVRNSNBJROM-UHFFFAOYSA-N
Mol Weight 340.47 g/mol
Molecular Formula C21H28N2O2
Exact Mass 340.215078 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1bNlDkR382P
Name Aspidospermidin-17-ol, 1-acetyl-
Alternate Name(s) 1-Acetylaspidospermidin-17-ol Aspidospermine, O-demethyl- Demethylaspidospermine
CAS Registry Number 2122-21-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H28N2O2
InChI InChI=1S/C21H28N2O2/c1-3-20-9-5-12-22-13-11-21(19(20)22)15-6-4-7-16(25)18(15)23(14(2)24)17(21)8-10-20/h4,6-7,17,19,25H,3,5,8-13H2,1-2H3
InChIKey XLNXVRNSNBJROM-UHFFFAOYSA-N
Molecular Weight 340.467 g/mol
SMILES Oc1cccc2c1N(C1CCC3(CCCN4CCC21C34)CC)C(C)=O
SPLASH splash10-00di-7913000000-83b1b54a90a10a4d3d4d
Source of Spectrum SD-1981-0-0
Wiley ID 1335434