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Cholest-2-eno[3,2-b]pyridine, 3'-methyl-
SpectraBase Compound ID BT3gJNJpXzT
InChI InChI=1S/C31H49N/c1-20(2)8-7-9-22(4)26-12-13-27-25-11-10-24-17-29-23(16-21(3)19-32-29)18-31(24,6)28(25)14-15-30(26,27)5/h16,19-20,22,24-28H,7-15,17-18H2,1-6H3
InChIKey JVNVHPUQDJQIIB-UHFFFAOYSA-N
Mol Weight 435.7 g/mol
Molecular Formula C31H49N
Exact Mass 435.386501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 30MWLn0iaCd
Name 1-(1,5-DIMETHYLHEXYL)-9,11A,13A-TRIMETHYL-2,3,3A,3B,4,5,5A,6,11,11A,11B,12,13,13A-TETRADECAHYDRO-1H-CYCLOPENTA[5,6]NAPHTHO[1,2-G]QUINOLINE
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Exact Mass 435.386500582 u
Formula C31H49N
InChI InChI=1S/C31H49N/c1-20(2)8-7-9-22(4)26-12-13-27-25-11-10-24-17-29-23(16-21(3)19-32-29)18-31(24,6)28(25)14-15-30(26,27)5/h16,19-20,22,24-28H,7-15,17-18H2,1-6H3
InChIKey JVNVHPUQDJQIIB-UHFFFAOYSA-N
Molecular Weight 435.740 g/mol
Nominal Mass 435 u
Number of Peaks 292
SMILES c1nc2CC3C(Cc2cc1C)(C1CCC2(C(C1CC3)CCC2C(CCCC(C)C)C)C)C
SPLASH splash10-0079-4960700000-be098e1c5d7b040b8703
Source File Reference LMCM-32961-189T
Synonyms 1,5,18-trimethyl-6-(6-methylheptan-2-yl)-16-azapentacyclo[11.8.0.0(2,10).0(5,9).0(15,20)]henicosa-15(20),16,18-triene
Wiley ID 8_8271