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Benzo[b]phenanthridin-5(6H)-one-12-d, 6-methyl-
SpectraBase Compound ID FA15FEk37Ns
InChI InChI=1S/C18H13NO/c1-19-17-11-13-7-3-2-6-12(13)10-16(17)14-8-4-5-9-15(14)18(19)20/h2-11H,1H3/i10D
InChIKey SDDMYCUOBHWSNR-MMIHMFRQSA-N
Mol Weight 260.31 g/mol
Molecular Formula C18H122DNO
Exact Mass 260.105991 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KFLKbHDfqBb
Name Benzo[b]phenanthridin-5(6H)-one-12-d, 6-methyl-
Alternate Name(s) 12-Deuterio-N-methylbenzo[b]phenanthridinone
CAS Registry Number 118170-38-0
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H12DNO
InChI InChI=1S/C18H13NO/c1-19-17-11-13-7-3-2-6-12(13)10-16(17)14-8-4-5-9-15(14)18(19)20/h2-11H,1H3/i10D
InChIKey SDDMYCUOBHWSNR-MMIHMFRQSA-N
Molecular Weight 260.314 g/mol
SMILES c12N(C(c3c(-c2c([2D])c2c(c1)cccc2)cccc3)=O)C
SPLASH splash10-03di-0090000000-e967199891fa2bf18085
Source of Spectrum J-54-427-15
Wiley ID 1262974