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1,1,4a,8,10a,10b-Hexamethyl-8-(4-methylpentyl)octadecahydrochrysene
SpectraBase Compound ID KUvSqXHLJ5k
InChI InChI=1S/C30H54/c1-22(2)11-9-16-27(5)19-20-29(7)23(21-27)12-13-25-28(6)17-10-15-26(3,4)24(28)14-18-30(25,29)8/h22-25H,9-21H2,1-8H3
InChIKey MDHNGUIZZLNVNV-UHFFFAOYSA-N
Mol Weight 414.8 g/mol
Molecular Formula C30H54
Exact Mass 414.422552 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 76YW4qWx93a
Name 1,1,4a,8,10a,10b-Hexamethyl-8-(4-methylpentyl)octadecahydrochrysene
CAS Registry Number 36441-74-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H54
InChI InChI=1S/C30H54/c1-22(2)11-9-16-27(5)19-20-29(7)23(21-27)12-13-25-28(6)17-10-15-26(3,4)24(28)14-18-30(25,29)8/h22-25H,9-21H2,1-8H3
InChIKey MDHNGUIZZLNVNV-UHFFFAOYSA-N
Molecular Weight 414.762 g/mol
SMILES C12(CCC3C(C2CCC2C1(CCC(C2)(C)CCCC(C)C)C)(CCCC3(C)C)C)C
SPLASH splash10-05mo-8900000000-96a64028e3f0f965196f
Source of Spectrum S-24-2487-5
Synonyms 2,4a,4b,7,7,10a-hexamethyl-2-(4-methylpentyl)-3,4,5,6,6a,8,9,10,10b,11,12,12a-dodecahydro-1H-chrysene 2-isohexyl-2,4a,4b,7,7,10a-hexamethyl-3,4,5,6,6a,8,9,10,10b,11,12,12a-dodecahydro-1H-chrysene Baccharane Baccharene
Wiley ID 1375851