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[6aR-(6aa,7b,10ab)]-4-acetyl-2-methoxy-7-methoxymethyl-7,10a-dimethyl-4,6,6a,7,8,9,10,10a-octahydrophenanthro[1,10-cd]pyrazole

View entire compound with spectra: 1 MS (GC)

[6aR-(6aa,7b,10ab)]-4-acetyl-2-methoxy-7-methoxymethyl-7,10a-dimethyl-4,6,6a,7,8,9,10,10a-octahydrophenanthro[1,10-cd]pyrazole
SpectraBase Compound ID JSFjuRDYfNQ
InChI InChI=1S/C21H28N2O3/c1-13(24)23-17-10-14(26-5)9-15-19(17)16(22-23)11-18-20(2,12-25-4)7-6-8-21(15,18)3/h9-10,18H,6-8,11-12H2,1-5H3/t18-,20-,21+/m0/s1
InChIKey IHRNAMPHWWUNQO-SESVDKBCSA-N
Mol Weight 356.47 g/mol
Molecular Formula C21H28N2O3
Exact Mass 356.209993 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EilGx0wODfT
Name [6aR-(6aa,7b,10ab)]-4-acetyl-2-methoxy-7-methoxymethyl-7,10a-dimethyl-4,6,6a,7,8,9,10,10a-octahydrophenanthro[1,10-cd]pyrazole
Alternate Name(s) (6aR,7R,10aS)-4-acetyl-2-methoxy-7-(methoxymethyl)-7,10a-dimethyl-4,6,6a,7,8,9,10,10a-octahydrodibenzo[cd,f]indazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H28N2O3
InChI InChI=1S/C21H28N2O3/c1-13(24)23-17-10-14(26-5)9-15-19(17)16(22-23)11-18-20(2,12-25-4)7-6-8-21(15,18)3/h9-10,18H,6-8,11-12H2,1-5H3/t18-,20-,21+/m0/s1
InChIKey IHRNAMPHWWUNQO-SESVDKBCSA-N
Molecular Weight 356.466 g/mol
SMILES c12n[n](c3c1c([C@]1(CCC[C@]([C@@]1(C2)[H])(COC)C)C)cc(c3)OC)C(=O)C
SPLASH splash10-0900-0039000000-56a155be2cca36135330
Source of Spectrum B-47-1483-0
Wiley ID 1345966