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5-(6-Hydroxy-5,5,8A-trimethyl-2-methylenedecahydronaphthalen-1-yl)-3-methylpentyl acetate, o-acetyl
SpectraBase Compound ID LuJ7tsLuOn9
InChI InChI=1S/C24H40O4/c1-16(13-15-27-18(3)25)8-10-20-17(2)9-11-21-23(5,6)22(28-19(4)26)12-14-24(20,21)7/h16,20-22H,2,8-15H2,1,3-7H3
InChIKey WOORPQKXQUWHGR-UHFFFAOYSA-N
Mol Weight 392.6 g/mol
Molecular Formula C24H40O4
Exact Mass 392.29266 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HvF3R6iHsMy
Name 5-(6-Hydroxy-5,5,8A-trimethyl-2-methylenedecahydronaphthalen-1-yl)-3-methylpentyl acetate, o-acetyl
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 392.292659764 u
Formula C24H40O4
InChI InChI=1S/C24H40O4/c1-16(13-15-27-18(3)25)8-10-20-17(2)9-11-21-23(5,6)22(28-19(4)26)12-14-24(20,21)7/h16,20-22H,2,8-15H2,1,3-7H3
InChIKey WOORPQKXQUWHGR-UHFFFAOYSA-N
Molecular Weight 392.580 g/mol
SMILES C(CC(C)CCC1C2(C)C(C(C(OC(=O)C)CC2)(C)C)CCC1=C)OC(C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.977638