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13,14,15,16-Tetranor-12-(2'-Furyl)-labdan-7-one
SpectraBase Compound ID LJKO3QErzEE
InChI InChI=1S/C20H30O2/c1-14-16(9-8-15-7-5-12-22-15)20(4)11-6-10-19(2,3)18(20)13-17(14)21/h5,7,12,14,16,18H,6,8-11,13H2,1-4H3/t14-,16-,18-,20+/m0/s1
InChIKey VUQHGTRVIBSUKN-PFSLXQJOSA-N
Mol Weight 302.46 g/mol
Molecular Formula C20H30O2
Exact Mass 302.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cw8uLS7KHCU
Name 13,14,15,16-Tetranor-12-(2'-Furyl)-labdan-7-one
Alternate Name(s) (3S,4S,4aR,8aS)-4-[2-(2-furyl)ethyl]-3,4a,8,8-tetramethyloctahydro-2(1H)-naphthalenone 11-(2'-Furyl)-labdan-7-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30O2
InChI InChI=1S/C20H30O2/c1-14-16(9-8-15-7-5-12-22-15)20(4)11-6-10-19(2,3)18(20)13-17(14)21/h5,7,12,14,16,18H,6,8-11,13H2,1-4H3/t14-,16-,18-,20+/m0/s1
InChIKey VUQHGTRVIBSUKN-PFSLXQJOSA-N
Molecular Weight 302.458 g/mol
SMILES [C@]12([C@@](CC(=O)[C@]([C@@]2(CCc2occc2)[H])(C)[H])(C(CCC1)(C)C)[H])C
SPLASH splash10-0089-9220000000-61f701d2adfb5e009f19
Source of Spectrum Y4-84-212-5
Wiley ID 1550089