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2-[(4aS,10aR)-6-methoxy-2,3,4,10a-tetrahydro-1H-phenanthren-4a-yl]ethyl-methyl-propyl-amine
SpectraBase Compound ID DVB8tt6RDIi
InChI InChI=1S/C21H31NO/c1-4-14-22(2)15-13-21-12-6-5-7-18(21)10-8-17-9-11-19(23-3)16-20(17)21/h8-11,16,18H,4-7,12-15H2,1-3H3/t18-,21+/m1/s1
InChIKey NBUQZXUHOQFVIA-NQIIRXRSSA-N
Mol Weight 313.49 g/mol
Molecular Formula C21H31NO
Exact Mass 313.240565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IbUBACVxVZG
Name 2-[(4aS,10aR)-6-methoxy-2,3,4,10a-tetrahydro-1H-phenanthren-4a-yl]ethyl-methyl-propyl-amine
Alternate Name(s) N-[2-[(4aS,10aR)-6-methoxy-2,3,4,10a-tetrahydro-1H-phenanthren-4a-yl]ethyl]-N-methyl-1-propanamine N-[2-[(4aS,10aR)-6-methoxy-2,3,4,10a-tetrahydro-1H-phenanthren-4a-yl]ethyl]-N-methyl-propan-1-amine
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Formula C21H31NO
InChI InChI=1S/C21H31NO/c1-4-14-22(2)15-13-21-12-6-5-7-18(21)10-8-17-9-11-19(23-3)16-20(17)21/h8-11,16,18H,4-7,12-15H2,1-3H3/t18-,21+/m1/s1
InChIKey NBUQZXUHOQFVIA-NQIIRXRSSA-N
Molecular Weight 313.485 g/mol
SMILES [C@@]12(c3c(ccc(c3)OC)C=C[C@]1(CCCC2)[H])CCN(CCC)C
SPLASH splash10-00di-0950000000-a2d6156e6257997f2a0b
Source of Spectrum K-2001-2401-5
Wiley ID 1580530