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(1ar,3ar,3bs,4S,8S,8ar,10As)-6-((R)-isopropyl)-3A,5A-dimethyl-hexadecahydro-cyclopenta[A]cyclopropa[2,3]cyclopenta[1,2-F]naphthalene

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(1ar,3ar,3bs,4S,8S,8ar,10As)-6-((R)-isopropyl)-3A,5A-dimethyl-hexadecahydro-cyclopenta[A]cyclopropa[2,3]cyclopenta[1,2-F]naphthalene
SpectraBase Compound ID 4rA13GoB9b3
InChI InChI=1S/C22H36/c1-14(2)17-5-6-18-16-8-12-22-13-15(22)7-11-21(22,4)19(16)9-10-20(17,18)3/h14-19H,5-13H2,1-4H3/t15-,16+,17-,18+,19+,20-,21-,22+/m1/s1
InChIKey CUFGWRKGKZFAJZ-HEEHBEPISA-N
Mol Weight 300.5 g/mol
Molecular Formula C22H36
Exact Mass 300.281701 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DF9PsHULW7I
Name (1ar,3ar,3bs,4S,8S,8ar,10As)-6-((R)-isopropyl)-3A,5A-dimethyl-hexadecahydro-cyclopenta[A]cyclopropa[2,3]cyclopenta[1,2-F]naphthalene
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 300.281701159 u
Formula C22H36
InChI InChI=1S/C22H36/c1-14(2)17-5-6-18-16-8-12-22-13-15(22)7-11-21(22,4)19(16)9-10-20(17,18)3/h14-19H,5-13H2,1-4H3/t15-,16+,17-,18+,19+,20-,21-,22+/m1/s1
InChIKey CUFGWRKGKZFAJZ-HEEHBEPISA-N
Molecular Weight 300.530 g/mol
SMILES C1C[C@]2([C@]3(C[C@@]13[H])CC[C@@]1([C@@]2(CC[C@]2([C@]1(CC[C@@]2(C(C)C)[H])[H])C)[H])[H])C