For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(+)-(1S,3R)-4(R)(e)-(3,3-Dimethylbutyl)adamantan-2-one
SpectraBase Compound ID LwNfKrvplx4
InChI InChI=1S/C16H26O/c1-16(2,3)5-4-13-11-6-10-7-12(9-11)15(17)14(13)8-10/h10-14H,4-9H2,1-3H3/t10?,11-,12+,13-,14-/m1/s1
InChIKey OXUGNZBHFFLZRF-ZLMOABSSSA-N
Mol Weight 234.38 g/mol
Molecular Formula C16H26O
Exact Mass 234.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID E2ollsAdGQb
Name (+)-(1S,3R)-4(R)(e)-(3,3-Dimethylbutyl)adamantan-2-one
Alternate Name(s) (1R,3R,4R)-4-(3,3-dimethylbutyl)tricyclo[3.3.1.1(3,7)]decan-2-one
CAS Registry Number 103364-81-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H26O
InChI InChI=1S/C16H26O/c1-16(2,3)5-4-13-11-6-10-7-12(9-11)15(17)14(13)8-10/h10-14H,4-9H2,1-3H3/t10?,11-,12+,13-,14-/m1/s1
InChIKey OXUGNZBHFFLZRF-ZLMOABSSSA-N
Molecular Weight 234.383 g/mol
SMILES [C@@]12(C([C@@]3([H])CC(C2)C[C@@]([C@]1(CCC(C)(C)C)[H])(C3)[H])=O)[H]
SPLASH splash10-00di-0920000000-94e2d05d5b5e83d9df4a
Source of Spectrum C-108-4497-10
Wiley ID 1236649