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5.alpha.-Pregnane-3.beta.,20.alpha.-diamine, N,N,N',N'-tetramethyl-

View entire compound with spectra: 1 NMR, and 2 MS (GC)

5.alpha.-Pregnane-3.beta.,20.alpha.-diamine, N,N,N',N'-tetramethyl-
SpectraBase Compound ID 4ilOofQwWVr
InChI InChI=1S/C25H46N2/c1-17(26(4)5)21-10-11-22-20-9-8-18-16-19(27(6)7)12-14-24(18,2)23(20)13-15-25(21,22)3/h17-23H,8-16H2,1-7H3
InChIKey IHGKQRLXUYWOQB-UHFFFAOYSA-N
Mol Weight 374.7 g/mol
Molecular Formula C25H46N2
Exact Mass 374.366099 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H2E2xa2rgGt
Name 5.alpha.-Pregnane-3.beta.,20.alpha.-diamine, N,N,N',N'-tetramethyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 374.366099489 u
Formula C25H46N2
InChI InChI=1S/C25H46N2/c1-17(26(4)5)21-10-11-22-20-9-8-18-16-19(27(6)7)12-14-24(18,2)23(20)13-15-25(21,22)3/h17-23H,8-16H2,1-7H3
InChIKey IHGKQRLXUYWOQB-UHFFFAOYSA-N
Molecular Weight 374.657 g/mol
SMILES C[C@]12[C@]([C@]3([C@](CC2)([C@]2(C)[C@@](CC3)(C[C@](CC2)(N(C)C)[H])[H])[H])[H])(CC[C@@]1([C@@](N(C)C)(C)[H])[H])[H]