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CHOLESTAN-3-ONE DIMETHYLHYDRAZONE
SpectraBase Compound ID 768GJJevcoP
InChI InChI=1S/C29H52N2/c1-20(2)9-8-10-21(3)25-13-14-26-24-12-11-22-19-23(30-31(6)7)15-17-28(22,4)27(24)16-18-29(25,26)5/h20-22,24-27H,8-19H2,1-7H3/b30-23+/t21-,22?,24+,25-,26+,27+,28+,29-/m1/s1
InChIKey XTJDGIVSIZEYOW-VZDYKKTGSA-N
Mol Weight 428.7 g/mol
Molecular Formula C29H52N2
Exact Mass 428.41305 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 59mIGkkUKtL
Name CHOLESTAN-3-ONE DIMETHYLHYDRAZONE
CAS Registry Number 54966-63-1
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 428.413049682 u
Formula C29H52N2
InChI InChI=1S/C29H52N2/c1-20(2)9-8-10-21(3)25-13-14-26-24-12-11-22-19-23(30-31(6)7)15-17-28(22,4)27(24)16-18-29(25,26)5/h20-22,24-27H,8-19H2,1-7H3/b30-23+/t21-,22?,24+,25-,26+,27+,28+,29-/m1/s1
InChIKey XTJDGIVSIZEYOW-VZDYKKTGSA-N
Molecular Weight 428.749 g/mol
Nominal Mass 428 u
Number of Peaks 261
SMILES C1\C(CC2CC[C@]3([C@@]4(CC[C@@]([C@]4(CC[C@@]3([C@]2(C1)C)[H])C)([C@@](CCCC(C)C)(C)[H])[H])[H])[H])=N/N(C)C
SPLASH splash10-004i-9410600000-b7d159863fdcbf6599df
Source File Reference LMCM-66064-777U
Synonyms N'-[17-(1,5-DIMETHYL-HEXYL)-10,13-DIMETHYL-HEXADECAHYDRO-CYCLOPENTA[A]PHENANTHREN-3-YLIDENE]-N,N-DIMETHYL-HYDRAZINE 2-[(1S,2S,5E,10R,11S,14R,15R)-2,15-dimethyl-14-[(2R)-6-methylheptan-2-yl]tetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan-5-ylidene]-1,1-dimethylhydrazine
Wiley ID 8_8317