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(endo)-2,7,7-Trimethylbicyclo[2.2.1]-heptane and (exo)-2,7,7-Trimethylbicyclo[2.2.1]-heptane

View entire compound with spectra: 1 MS (GC)

(endo)-2,7,7-Trimethylbicyclo[2.2.1]-heptane and (exo)-2,7,7-Trimethylbicyclo[2.2.1]-heptane
SpectraBase Compound ID 2o3nsnHaYwL
InChI InChI=1S/2C10H18/c2*1-7-6-8-4-5-9(7)10(8,2)3/h2*7-9H,4-6H2,1-3H3/t2*7-,8-,9+/m10/s1
InChIKey RLSMGARTFSZBNL-HBBTVXTMSA-N
Mol Weight 276.51 g/mol
Molecular Formula C20H36
Exact Mass 276.281701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EXZyr0pMrpm
Name (endo)-2,7,7-Trimethylbicyclo[2.2.1]-heptane and (exo)-2,7,7-Trimethylbicyclo[2.2.1]-heptane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H36
InChI InChI=1S/2C10H18/c2*1-7-6-8-4-5-9(7)10(8,2)3/h2*7-9H,4-6H2,1-3H3/t2*7-,8-,9+/m10/s1
InChIKey RLSMGARTFSZBNL-HBBTVXTMSA-N
Literature Reference DOI 10.1002/hc.1022
Molecular Weight 276.508 g/mol
SMILES C1C[C@]2(C[C@@]([C@@]1(C2(C)C)[H])(C)[H])[H].C1C[C@@]2([H])C([C@@]1([C@@](C2)(C)[H])[H])(C)C
SPLASH splash10-0a59-9000000000-b4040a7d47b1f1c1a678
Source of Spectrum HAC-12-143-23+24
Synonyms (1S,2R,4S)-2,7,7-trimethylbicyclo[2.2.1]heptane-(1S,2S,4S)-2,7,7-trimethylbicyclo[2.2.1]heptane (1/1)
Wiley ID 1783320