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4,4-D2-cholesterol
SpectraBase Compound ID DaLOCOQYAl0
InChI InChI=1S/C27H46O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9,18-19,21-25,28H,6-8,10-17H2,1-5H3/t19-,21+,22+,23?,24?,25?,26+,27-/m1/s1/i17D2
InChIKey HVYWMOMLDIMFJA-KTRVFGGGSA-N
Mol Weight 388.7 g/mol
Molecular Formula C27H442D2O
Exact Mass 388.36742 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bo6awPVyW1D
Name 4,4-D2-cholesterol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H44D2O
InChI InChI=1S/C27H46O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9,18-19,21-25,28H,6-8,10-17H2,1-5H3/t19-,21+,22+,23?,24?,25?,26+,27-/m1/s1/i17D2
InChIKey HVYWMOMLDIMFJA-KTRVFGGGSA-N
Molecular Weight 388.676 g/mol
SMILES O[C@]1(CC[C@@]2(C3CC[C@]4(C([C@@]3(CC=C2C1([2D])[2D])[H])CCC4[C@@](CCCC(C)C)(C)[H])C)C)[H]
SPLASH splash10-000i-5948000000-aba79a86298bfd3689a7
Source of Spectrum SD-1992-0-0
Wiley ID 1363202