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(+-)-(1S,4as,8ar)-1,2,3,4,4A,5,8-heptahydro-6,8A-dimethylnaphthalen-1-yl acetate
SpectraBase Compound ID HpjEoemDUbB
InChI InChI=1S/C11H18O/c1-11-8-3-2-5-9(11)6-4-7-10(11)12/h2-3,9-10,12H,4-8H2,1H3/t9-,10+,11-/m1/s1
InChIKey YTPQSXGZFJMULR-OUAUKWLOSA-N
Mol Weight 166.26 g/mol
Molecular Formula C11H18O
Exact Mass 166.135765 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Hdzl3MGXZAX
Name (+-)-(1S,4as,8ar)-1,2,3,4,4A,5,8-heptahydro-6,8A-dimethylnaphthalen-1-yl acetate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 166.135765199 u
Formula C11H18O
InChI InChI=1S/C11H18O/c1-11-8-3-2-5-9(11)6-4-7-10(11)12/h2-3,9-10,12H,4-8H2,1H3/t9-,10+,11-/m1/s1
InChIKey YTPQSXGZFJMULR-OUAUKWLOSA-N
Molecular Weight 166.264 g/mol
SMILES [C@]12([C@@](O)(CCC[C@]2(CC=CC1)[H])[H])C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.86396