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4A-Piperidyl hexahydrobiphenylene
SpectraBase Compound ID D0PwqhnGJEV
InChI InChI=1S/C17H23N/c1-6-12-18(13-7-1)17-11-5-4-10-16(17)14-8-2-3-9-15(14)17/h2-3,8-9,16H,1,4-7,10-13H2
InChIKey YSXPXBOBMSADAA-UHFFFAOYSA-N
Mol Weight 241.38 g/mol
Molecular Formula C17H23N
Exact Mass 241.18305 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID D7DenuLjGrp
Name 4A-Piperidyl hexahydrobiphenylene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 241.183049745 u
Formula C17H23N
InChI InChI=1S/C17H23N/c1-6-12-18(13-7-1)17-11-5-4-10-16(17)14-8-2-3-9-15(14)17/h2-3,8-9,16H,1,4-7,10-13H2
InChIKey YSXPXBOBMSADAA-UHFFFAOYSA-N
Molecular Weight 241.378 g/mol
SMILES C1=CC=C2C(=C1)C1(C2CCCC1)N1CCCCC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.952795