Poly[1-(cholesteryloxyfumaroyloxy)ethylene]

SpectraBase Compound ID	1qFagewBSrQ
InChI	InChI=1S/C35H56O4/c1-8-25(5)38-32(36)16-17-33(37)39-27-18-20-34(6)26(22-27)12-13-31-30(34)15-14-29-28(19-21-35(29,31)7)24(4)11-9-10-23(2)3/h12,16-17,23-25,27-31H,8-11,13-15,18-22H2,1-7H3/b17-16+
InChIKey	YFEJNBXXKJEQEZ-WUKNDPDISA-N Google Search
Mol Weight	540.8 g/mol
Molecular Formula	C35H56O4
Exact Mass	540.41786 g/mol

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SpectraBase Spectrum ID	4WysWp958Kq
Name	Poly[1-(cholesteryloxyfumaroyloxy)ethylene]
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	540.417860279 u
Formula	C35H56O4
InChI	InChI=1S/C35H56O4/c1-8-25(5)38-32(36)16-17-33(37)39-27-18-20-34(6)26(22-27)12-13-31-30(34)15-14-29-28(19-21-35(29,31)7)24(4)11-9-10-23(2)3/h12,16-17,23-25,27-31H,8-11,13-15,18-22H2,1-7H3/b17-16+
InChIKey	YFEJNBXXKJEQEZ-WUKNDPDISA-N
Molecular Weight	540.829 g/mol
Nominal Mass	540 u
SMILES	C(C(C1CCC2(C1CCC1C2CC=C2C1(CCC(OC(\C=C\C(OC(CC)C)=O)=O)C2)C)C)C)CCC(C)C
Spectrum/Structure Validation Score (Raman)	0.989793