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Bicyclo[2.2.1]heptane, 1,2,3,7,7-pentamethyl-, [1S-(exo,exo)]-
SpectraBase Compound ID 6caXrexHWJx
InChI InChI=1S/C12H22/c1-8-9(2)12(5)7-6-10(8)11(12,3)4/h8-10H,6-7H2,1-5H3/t8?,9?,10-,12-/m0/s1
InChIKey SXXGGTBFRBWZAI-GZJRGEOXSA-N
Mol Weight 166.31 g/mol
Molecular Formula C12H22
Exact Mass 166.172151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L1oM6PJSET7
Name Bicyclo[2.2.1]heptane, 1,2,3,7,7-pentamethyl-, [1S-(exo,exo)]-
CAS Registry Number 59581-85-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22
InChI InChI=1S/C12H22/c1-8-9(2)12(5)7-6-10(8)11(12,3)4/h8-10H,6-7H2,1-5H3/t8?,9?,10-,12-/m0/s1
InChIKey SXXGGTBFRBWZAI-GZJRGEOXSA-N
Molecular Weight 166.308 g/mol
SMILES [C@]12(C([C@@](CC2)(C(C1C)C)[H])(C)C)C
SPLASH splash10-001j-9100000000-09b056a3f1b56d5faf41
Source of Spectrum F-32-313-0
Synonyms (-)-7-2-exo.3-exo-dimethylbornane (1S)-1,2,3,7,7-pentamethylbicyclo[2.2.1]heptane
Wiley ID 1163306