Cholestan, 3-[N,N-dioctadecylamino]-

SpectraBase Compound ID	2vgTxZcvldB
InChI	InChI=1S/C63H121N/c1-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-51-64(52-39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-2)57-47-49-62(6)56(53-57)43-44-58-60-46-45-59(55(5)42-40-41-54(3)4)63(60,7)50-48-61(58)62/h54-61H,8-53H2,1-7H3
InChIKey	BORKSLIULVEDSS-UHFFFAOYSA-N Google Search
Mol Weight	892.7 g/mol
Molecular Formula	C63H121N
Exact Mass	891.949903 g/mol

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SpectraBase Spectrum ID	A0YI6nueARO
Name	Cholestan, 3-[N,N-dioctadecylamino]-
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	891.949902900 u
Formula	C63H121N
InChI	InChI=1S/C63H121N/c1-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-51-64(52-39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-2)57-47-49-62(6)56(53-57)43-44-58-60-46-45-59(55(5)42-40-41-54(3)4)63(60,7)50-48-61(58)62/h54-61H,8-53H2,1-7H3
InChIKey	BORKSLIULVEDSS-UHFFFAOYSA-N
Molecular Weight	892.668 g/mol
SMILES	C1(CCC2(C(C1)CCC1C2CCC2(C1CCC2C(C)CCCC(C)C)C)C)N(CCCCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCC