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9,10[1',2']-Benzenoanthracene, 9,10-dihydro-1,4-dimethoxy-5,16-di(methoxy-D3)-
SpectraBase Compound ID Lfg00AvWUsU
InChI InChI=1S/C24H22O4/c1-25-15-9-5-7-13-19(15)21-14-8-6-10-16(26-2)20(14)22(13)24-18(28-4)12-11-17(27-3)23(21)24/h5-12,21-22H,1-4H3/t21-,22-/m0/s1/i1D3,2D3
InChIKey JXMQCVHZGBMXQB-PIAPPPQWSA-N
Mol Weight 380.47 g/mol
Molecular Formula C24H162D6O4
Exact Mass 380.18947 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LtBRvDlZIJg
Name 9,10[1',2']-Benzenoanthracene, 9,10-dihydro-1,4-dimethoxy-5,16-di(methoxy-D3)-
Alternate Name(s) 9,10-Dihydro-1,4-dimethoxy-5,16-bis(trideuteriomethoxy)-9,10-[1',2']benzenoanthracene
CAS Registry Number 103495-58-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H16D6O4
InChI InChI=1S/C24H22O4/c1-25-15-9-5-7-13-19(15)21-14-8-6-10-16(26-2)20(14)22(13)24-18(28-4)12-11-17(27-3)23(21)24/h5-12,21-22H,1-4H3/t21-,22-/m0/s1/i1D3,2D3
InChIKey JXMQCVHZGBMXQB-PIAPPPQWSA-N
Molecular Weight 380.473 g/mol
SMILES [C@@]12(c3c(c(OC)ccc3OC)[C@](c3c1cccc3OC([2D])([2D])[2D])(c1c2c(OC([2D])([2D])[2D])ccc1)[H])[H]
SPLASH splash10-001j-0009000000-a48e3daf717395773cd7
Source of Spectrum K-119-1035-0
Wiley ID 1356906