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7-(1,5-Dimethylhexyl)-4a,6a-dimethyl-1,2,3,4,4a,4b,5,6,6a,7,8,9,9a,9b,10,14a-hexadecahydroindeno[4,5-d]tetraazolo[1,5-a][1]benzazepine

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7-(1,5-Dimethylhexyl)-4a,6a-dimethyl-1,2,3,4,4a,4b,5,6,6a,7,8,9,9a,9b,10,14a-hexadecahydroindeno[4,5-d]tetraazolo[1,5-a][1]benzazepine
SpectraBase Compound ID 9fMNFzgM4Os
InChI InChI=1S/C27H46N4/c1-18(2)9-8-10-19(3)21-12-13-22-20-17-25-28-29-30-31(25)24-11-6-7-15-27(24,5)23(20)14-16-26(21,22)4/h18-24H,6-17H2,1-5H3
InChIKey NYTLYQYMYXRCEM-UHFFFAOYSA-N
Mol Weight 426.7 g/mol
Molecular Formula C27H46N4
Exact Mass 426.372247 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LhPfzJe4VSB
Name 7-(1,5-Dimethylhexyl)-4a,6a-dimethyl-1,2,3,4,4a,4b,5,6,6a,7,8,9,9a,9b,10,14a-hexadecahydroindeno[4,5-d]tetraazolo[1,5-a][1]benzazepine
CAS Registry Number 66233-39-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H46N4
InChI InChI=1S/C27H46N4/c1-18(2)9-8-10-19(3)21-12-13-22-20-17-25-28-29-30-31(25)24-11-6-7-15-27(24,5)23(20)14-16-26(21,22)4/h18-24H,6-17H2,1-5H3
InChIKey NYTLYQYMYXRCEM-UHFFFAOYSA-N
Molecular Weight 426.693 g/mol
SMILES CC(C)CCCC(C)C1CCC2C3Cc4nnn[n]4C4CCCCC4(C)C3CCC12C
SPLASH splash10-052k-9634100000-f64ce6059b1263c41443
Source of Spectrum O-22-806-5
Synonyms 6-Aza-.beta.-homo-5.alpha.-cholestano[6,7-d]tetrazole 6-Aza-B-homo-5.alpha.-cholestano[6,7-d]tetrazole
Wiley ID 1380098