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Lobscurinol
SpectraBase Compound ID 6WIc4Lw6AAb
InChI InChI=1S/C17H25NO2/c1-12-9-13-11-15(19)14-5-3-7-18(2)8-4-6-17(13,14)16(20)10-12/h5,10,13,15,19H,3-4,6-9,11H2,1-2H3/b14-5-/t13-,15-,17-/m0/s1
InChIKey FDZSBCAXCDLESQ-LDMLGLOKSA-N
Mol Weight 275.39 g/mol
Molecular Formula C17H25NO2
Exact Mass 275.188529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CERRPn7vlN5
Name Lobscurinol
Alternate Name(s) (8S,9aS)-8-hydroxy-4,11-dimethyl-1,2,3,4,5,6,8,9,9a,10-decahydro-13H-indeno[1,7a-e]azonin-13-one
CAS Registry Number 123165-90-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H25NO2
InChI InChI=1S/C17H25NO2/c1-12-9-13-11-15(19)14-5-3-7-18(2)8-4-6-17(13,14)16(20)10-12/h5,10,13,15,19H,3-4,6-9,11H2,1-2H3/b14-5-/t13-,15-,17-/m0/s1
InChIKey FDZSBCAXCDLESQ-LDMLGLOKSA-N
Molecular Weight 275.392 g/mol
SMILES O[C@@]1(\C=2[C@]3(C(C=C(C[C@]3(C1)[H])C)=O)CCCN(C)CCC/2)[H]
SPLASH splash10-053r-9000000000-42fa61e54f40b4a12544
Source of Spectrum I-67-1085-19
Wiley ID 1279272