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Norbornane, 2-chloro-1,5,5-trimethyl-, exo-

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Norbornane, 2-chloro-1,5,5-trimethyl-, exo-
SpectraBase Compound ID GWUPi3GbXZP
InChI InChI=1S/C10H17Cl/c1-9(2)6-10(3)5-7(9)4-8(10)11/h7-8H,4-6H2,1-3H3/t7-,8+,10+/m1/s1
InChIKey XUAGOZRNKAEAJS-WEDXCCLWSA-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 7SIPSdmTAA0
Name Norbornane, 2-chloro-1,5,5-trimethyl-, exo-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 172.101878247 u
Formula C10H17Cl
InChI InChI=1S/C10H17Cl/c1-9(2)6-10(3)5-7(9)4-8(10)11/h7-8H,4-6H2,1-3H3/t7-,8+,10+/m1/s1
InChIKey XUAGOZRNKAEAJS-WEDXCCLWSA-N
Molecular Weight 172.699 g/mol
SMILES C1(C)(C)[C@]2(C[C@](C1)(C)[C@](C2)(Cl)[H])[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.957501