John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=2rOX2vCfM4W SpectraBase Spectrum ID=GIRQTFaVR5s

(accessed ).
1H-Isoindole-1,3(2H)-dione, 2-[(3.beta.,25R)-3-(acetyloxy)cholest-5-en-26-yl]-
SpectraBase Compound ID 2rOX2vCfM4W
InChI InChI=1S/C37H51NO4/c1-23(22-38-34(40)28-11-6-7-12-29(28)35(38)41)9-8-10-24(2)31-15-16-32-30-14-13-26-21-27(42-25(3)39)17-19-36(26,4)33(30)18-20-37(31,32)5/h6-7,11-13,23-24,27,30-33H,8-10,14-22H2,1-5H3/t23-,24-,27+,30+,31-,32+,33+,36+,37-/m1/s1
InChIKey ZFPUJTOLLZGMIJ-PZHRMZLZSA-N
Mol Weight 573.8 g/mol
Molecular Formula C37H51NO4
Exact Mass 573.381809 g/mol

Mass Spectrum (MS)

Mass Spectrum (MS)

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SpectraBase Spectrum ID GIRQTFaVR5s
Name 1H-Isoindole-1,3(2H)-dione, 2-[(3.beta.,25R)-3-(acetyloxy)cholest-5-en-26-yl]-
Alternate Name(s) Cholestane, 1H-isoindole-1,3(2H)-dione deriv. (25R)-26-Phthalimido-5-cholesten-3.beta.-ol-acetate (3beta,25R)-26-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)cholest-5-en-3-yl acetate
CAS Registry Number 71472-93-0
Classification Cholesteryl esters
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Formula C37H51NO4
InChI InChI=1S/C37H51NO4/c1-23(22-38-34(40)28-11-6-7-12-29(28)35(38)41)9-8-10-24(2)31-15-16-32-30-14-13-26-21-27(42-25(3)39)17-19-36(26,4)33(30)18-20-37(31,32)5/h6-7,11-13,23-24,27,30-33H,8-10,14-22H2,1-5H3/t23-,24-,27+,30+,31-,32+,33+,36+,37-/m1/s1
InChIKey ZFPUJTOLLZGMIJ-PZHRMZLZSA-N
SPLASH splash10-03di-0941180000-09880a8003240433479e
Source of Spectrum K-112-2686-0
SpectraBase Batch ID Gy6Ovc6obgx