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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 6RcSFy3GBe3
Name
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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 435.3853
SMILES C12CCC3(C(CCC3C1CCC1Cc3ncc(C)cc3CC21C)C(C)CCCC(C)C)C
SPLASH splash10-0079-4960700000-be098e1c5d7b040b8703
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany