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(1S*,6S*,7S*)-7-Chlorotricyclo[5.3.2.0(1,6)]dodecane
SpectraBase Compound ID 3coKs2bmIdw
InChI InChI=1S/C12H19Cl/c13-12-7-3-6-11(8-9-12)5-2-1-4-10(11)12/h10H,1-9H2/t10-,11-,12-/m0/s1
InChIKey BBRHGXPYSIZFGO-SRVKXCTJSA-N
Mol Weight 198.74 g/mol
Molecular Formula C12H19Cl
Exact Mass 198.117528 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8JMGtgavtV9
Name (1S*,6S*,7S*)-7-Chlorotricyclo[5.3.2.0(1,6)]dodecane
CAS Registry Number 94345-91-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H19Cl
InChI InChI=1S/C12H19Cl/c13-12-7-3-6-11(8-9-12)5-2-1-4-10(11)12/h10H,1-9H2/t10-,11-,12-/m0/s1
InChIKey BBRHGXPYSIZFGO-SRVKXCTJSA-N
Molecular Weight 198.737 g/mol
SMILES [C@@]12([C@@]3([C@](CCCC3)(CC1)CCC2)[H])Cl
SPLASH splash10-03di-0900000000-92dc09a0e01a3768cbcd
Source of Spectrum J-50-491-25
Synonyms (1S,6S,7S)-7-chlorotricyclo[5.3.2.0(1,6)]dodecane
Wiley ID 1195732