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1,2,3-Trimethylcyclopentane
SpectraBase Compound ID 21K1jOd9iGP
InChI InChI=1S/C8H16/c1-6-4-5-7(2)8(6)3/h6-8H,4-5H2,1-3H3
InChIKey VCWNHOPGKQCXIQ-UHFFFAOYSA-N
Mol Weight 112.22 g/mol
Molecular Formula C8H16
Exact Mass 112.125201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LBOuO6u3tFG
Name 1,2,3-Trimethylcyclopentane
CAS Registry Number 2613-69-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H16
InChI InChI=1S/C8H16/c1-6-4-5-7(2)8(6)3/h6-8H,4-5H2,1-3H3
InChIKey VCWNHOPGKQCXIQ-UHFFFAOYSA-N
Molecular Weight 112.216 g/mol
SMILES C1CC(C(C1C)C)C
SPLASH splash10-0ab9-9000000000-e3391a20733ed87db527
Source of Spectrum HE-1982-0-0
Synonyms 1,2,3-Trimethylcyclopentane, cis, cis 1,2,3-Trimethylcyclopentane, cis, trans Cyclopentane, 1,2,3-trimethyl-, (1.alpha.,2.alpha.,3.alpha.)- 1,2,3-Trimethylcyclopentane, trans, cis 1,cis-2,cis-3-Trimethylcyclopentane Cyclopentane, 1,2,3-trimethyl- Cyclopentane, 1,2,3-trimethyl-, (1.alpha.,2.alpha.,3.beta.)- Cyclopentane, 1,2,3-trimethyl-, cis-1,2,cis-1,3- Cyclopentane, 1,2,3-trimethyl-, (1alpha,2alpha,3alpha)- Cyclopentane, 1,2,3-trimethyl-, (1alpha,2alpha,3beta)- Cyclopentane, 1,2,3-trimethyl-, cis-1,2,trans-1,3- trans,cis-1,2,3-Trimethylcyclopentane
Wiley ID 1123694