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Des-A,B-18,21-dinorcholestane-8-one
SpectraBase Compound ID 82uALz8OPBB
InChI InChI=1S/C16H28O/c1-12(2)6-3-4-7-13-10-11-15-14(13)8-5-9-16(15)17/h12-15H,3-11H2,1-2H3/t13-,14+,15+/m0/s1
InChIKey HQXQQTCLTLMFEU-RRFJBIMHSA-N
Mol Weight 236.4 g/mol
Molecular Formula C16H28O
Exact Mass 236.214016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1ObzZGjI36
Name Des-A,B-18,21-dinorcholestane-8-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H28O
InChI InChI=1S/C16H28O/c1-12(2)6-3-4-7-13-10-11-15-14(13)8-5-9-16(15)17/h12-15H,3-11H2,1-2H3/t13-,14+,15+/m0/s1
InChIKey HQXQQTCLTLMFEU-RRFJBIMHSA-N
Ionization Type EI
Molecular Weight 236.399 g/mol
SMILES C1C[C@]2([C@](C(C1)=O)(CC[C@@]2(CCCCC(C)C)[H])[H])[H]
SPLASH splash10-059l-0980000000-110034ed09060a47ccce
Source of Spectrum US8575136B2
Wiley ID 1847832