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Bicyclo[3.1.1]heptane, 3-chloro-2,6,6-trimethyl-
SpectraBase Compound ID 4aujg5zfT4t
InChI InChI=1S/C10H17Cl/c1-6-8-4-7(5-9(6)11)10(8,2)3/h6-9H,4-5H2,1-3H3
InChIKey PPXZTFXSBNJCKA-UHFFFAOYSA-N
Mol Weight 172.7 g/mol
Molecular Formula C10H17Cl
Exact Mass 172.101878 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9la2tyZJ39W
Name Bicyclo[3.1.1]heptane, 3-chloro-2,6,6-trimethyl-
Alternate Name(s) 3-Chloro-2,6,6-trimethylbicyclo[3.1.1]heptane Isopinocampheyl chloride
CAS Registry Number 117227-80-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H17Cl
InChI InChI=1S/C10H17Cl/c1-6-8-4-7(5-9(6)11)10(8,2)3/h6-9H,4-5H2,1-3H3
InChIKey PPXZTFXSBNJCKA-UHFFFAOYSA-N
Molecular Weight 172.699 g/mol
SMILES C12C(C)(C)C(C2)CC(C1C)Cl
SPLASH splash10-014i-0900000000-0755a16fbcbbd2c45a2b
Source of Spectrum J-53-5667-0
Wiley ID 1168936