For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1-(1,5-Dimethylhexyl)-8,11a,13a-trimethyl-2,3,3a,3b,4,5,5a,6,11,11a,11b,12,13,13a-tetradecahydro-1H-cyclopenta[5,6]naphtho[2,1-g]isoquinoline
SpectraBase Compound ID 28Z0AAKj1ua
InChI InChI=1S/C31H49N/c1-20(2)8-7-9-21(3)27-12-13-28-26-11-10-25-17-23-16-22(4)32-19-24(23)18-31(25,6)29(26)14-15-30(27,28)5/h16,19-21,25-29H,7-15,17-18H2,1-6H3
InChIKey ZFPHXHLVYYRKDF-UHFFFAOYSA-N
Mol Weight 435.7 g/mol
Molecular Formula C31H49N
Exact Mass 435.386501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 96Cj9lOBn6T
Name 1-(1,5-Dimethylhexyl)-8,11a,13a-trimethyl-2,3,3a,3b,4,5,5a,6,11,11a,11b,12,13,13a-tetradecahydro-1H-cyclopenta[5,6]naphtho[2,1-g]isoquinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H49N
InChI InChI=1S/C31H49N/c1-20(2)8-7-9-21(3)27-12-13-28-26-11-10-25-17-23-16-22(4)32-19-24(23)18-31(25,6)29(26)14-15-30(27,28)5/h16,19-21,25-29H,7-15,17-18H2,1-6H3
InChIKey ZFPHXHLVYYRKDF-UHFFFAOYSA-N
Molecular Weight 435.740 g/mol
SMILES C12C3(Cc4c(CC3CCC1C1C(CC2)(C)C(C(CCCC(C)C)C)CC1)cc(nc4)C)C
SPLASH splash10-05au-6950200000-f0d48fddd75028994d3e
Synonyms Cholest-2-eno[2,3-c]pyridine, 3'-methyl- Cholest-2-eno[2,3-c]pyridine, 6'-methyl-
Wiley ID 1474861