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Norbornane, 2-chloro-2,5,5-trimethyl-, exo-
SpectraBase Compound ID 36TBox5fHiW
InChI InChI=1S/C10H17Cl/c1-9(2)5-8-4-7(9)6-10(8,3)11/h7-8H,4-6H2,1-3H3/t7-,8-,10-/m0/s1
InChIKey SYYMZEWOAAUVMT-NRPADANISA-N
Mol Weight 172.7 g/mol
Molecular Formula C10H17Cl
Exact Mass 172.101878 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DDpcQMceKv5
Name Norbornane, 2-chloro-2,5,5-trimethyl-, exo-
Comments Computed using SmartSpectra Model v1.42
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Exact Mass 172.101878247 u
Formula C10H17Cl
InChI InChI=1S/C10H17Cl/c1-9(2)5-8-4-7(9)6-10(8,3)11/h7-8H,4-6H2,1-3H3/t7-,8-,10-/m0/s1
InChIKey SYYMZEWOAAUVMT-NRPADANISA-N
Molecular Weight 172.699 g/mol
SMILES C1(C)(C)[C@]2(C[C@@](C1)([C@@](C2)(C)Cl)[H])[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.949408