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(3aR,4aS,8aR,9aR)-3-[(Dodecylamino)methyl]decahydro-8a-methyl-5-methylidenenaphtho[2,3-b]furan-2(3H)-one
SpectraBase Compound ID Bss5Duvxgp3
InChI InChI=1S/C27H47NO2/c1-4-5-6-7-8-9-10-11-12-13-17-28-20-23-22-18-24-21(2)15-14-16-27(24,3)19-25(22)30-26(23)29/h22-25,28H,2,4-20H2,1,3H3/t22-,23?,24+,25-,27-/m1/s1
InChIKey CQEOJBNDKXTECA-MVRVLGECSA-N
Mol Weight 417.7 g/mol
Molecular Formula C27H47NO2
Exact Mass 417.36068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 307cGXmtlPe
Name (3aR,4aS,8aR,9aR)-3-[(Dodecylamino)methyl]decahydro-8a-methyl-5-methylidenenaphtho[2,3-b]furan-2(3H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H47NO2
InChI InChI=1S/C27H47NO2/c1-4-5-6-7-8-9-10-11-12-13-17-28-20-23-22-18-24-21(2)15-14-16-27(24,3)19-25(22)30-26(23)29/h22-25,28H,2,4-20H2,1,3H3/t22-,23?,24+,25-,27-/m1/s1
InChIKey CQEOJBNDKXTECA-MVRVLGECSA-N
Molecular Weight 417.678 g/mol
SMILES N(CC1[C@@]2([H])C[C@@]3([H])C(CCC[C@@]3(C[C@]2(OC1=O)[H])C)=C)CCCCCCCCCCCC
SPLASH splash10-06r6-4090000000-3a69a3a14674df4626f6
Source of Spectrum CBD-7-1696-4m
Synonyms (3aR,4aS,8aR,9aR)-3-((dodecylamino)methyl)-8a-methyl-5-methylenedecahydronaphtho[2,3-b]furan-2(3H)-one
Wiley ID 1786499