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D-Norpregnane (5.alpha.,14.alpha.)

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D-Norpregnane (5.alpha.,14.alpha.)
SpectraBase Compound ID nNky4Vza0r
InChI InChI=1S/C20H34/c1-4-14-13-18-16-9-8-15-7-5-6-11-19(15,2)17(16)10-12-20(14,18)3/h14-18H,4-13H2,1-3H3
InChIKey URLJBSBGHKEAED-UHFFFAOYSA-N
Mol Weight 274.5 g/mol
Molecular Formula C20H34
Exact Mass 274.266051 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Cf5Gjp6ZGri
Name D-Norpregnane (5.alpha.,14.alpha.)
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 274.266051095 u
Formula C20H34
InChI InChI=1S/C20H34/c1-4-14-13-18-16-9-8-15-7-5-6-11-19(15,2)17(16)10-12-20(14,18)3/h14-18H,4-13H2,1-3H3
InChIKey URLJBSBGHKEAED-UHFFFAOYSA-N
Molecular Weight 274.492 g/mol
SMILES CCC1C2(C)CCC3C4(C)CCCCC4CCC3C2C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.904002