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A-Norandrostane, 5-chloro-3-methyl-, (3.beta.,5.alpha.)-
SpectraBase Compound ID 6qVUY8EwLD7
InChI InChI=1S/C19H31Cl/c1-12-6-10-19(3)15-7-9-18(2)8-4-5-14(18)13(15)11-16(20)17(12)19/h12-17H,4-11H2,1-3H3/t12-,13-,14-,15-,16-,17+,18-,19+/m0/s1
InChIKey RIOKLYZXEMCPAG-RNGRNUFTSA-N
Mol Weight 294.91 g/mol
Molecular Formula C19H31Cl
Exact Mass 294.211429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BbbGjsLznsW
Name A-Norandrostane, 5-chloro-3-methyl-, (3.beta.,5.alpha.)-
CAS Registry Number 71057-87-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H31Cl
InChI InChI=1S/C19H31Cl/c1-12-6-10-19(3)15-7-9-18(2)8-4-5-14(18)13(15)11-16(20)17(12)19/h12-17H,4-11H2,1-3H3/t12-,13-,14-,15-,16-,17+,18-,19+/m0/s1
InChIKey RIOKLYZXEMCPAG-RNGRNUFTSA-N
Molecular Weight 294.910 g/mol
SMILES [C@@]12([C@@]3([C@@]([C@@]4(CCC[C@]4(CC3)C)[H])([H])C[C@@]([C@]2([C@@](C)(CC1)[H])[H])(Cl)[H])[H])C
SPLASH splash10-0006-0090000000-2fd8c6c7f407377677c3
Source of Spectrum K-112-1611-0
Synonyms Dicyclopenta[a,f]naphthalene, A-norandrostane deriv. (1S,3aR,3bS,5aS,8aS,8bS,10S,10aS)-10-chloro-1,3a,5a-trimethylhexadecahydrodicyclopenta[a,f]naphthalene 5.alpha.-chloro-3.beta.-methyl-a-nor-androstan
Wiley ID 1297645