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Cyclopentanecarbonitrile, 2,2,5-trimethyl-, trans-(.+-.)-

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Cyclopentanecarbonitrile, 2,2,5-trimethyl-, trans-(.+-.)-
SpectraBase Compound ID 68Vz6D9B4bH
InChI InChI=1S/C9H15N/c1-7-4-5-9(2,3)8(7)6-10/h7-8H,4-5H2,1-3H3/t7-,8+/m0/s1
InChIKey PIBOVTCLKURFOQ-JGVFFNPUSA-N
Mol Weight 137.23 g/mol
Molecular Formula C9H15N
Exact Mass 137.120449 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6es16cCNZTe
Name Cyclopentanecarbonitrile, 2,2,5-trimethyl-, trans-(.+-.)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 137.120449487 u
Formula C9H15N
InChI InChI=1S/C9H15N/c1-7-4-5-9(2,3)8(7)6-10/h7-8H,4-5H2,1-3H3/t7-,8+/m0/s1
InChIKey PIBOVTCLKURFOQ-JGVFFNPUSA-N
Molecular Weight 137.226 g/mol
SMILES C(#N)[C@]1(C(CC[C@@]1(C)[H])(C)C)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.929843