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(-)-(3ar,7ar)-7A-methylhexahydroindan-1-one

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

(-)-(3ar,7ar)-7A-methylhexahydroindan-1-one
SpectraBase Compound ID 6InilxaGqB
InChI InChI=1S/C10H16O/c1-10-7-3-2-4-8(10)5-6-9(10)11/h8H,2-7H2,1H3/t8-,10-/m1/s1
InChIKey WYKZJZRPDWKUBM-PSASIEDQSA-N
Mol Weight 152.24 g/mol
Molecular Formula C10H16O
Exact Mass 152.120115 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID H0n86qdAwQM
Name (-)-(3ar,7ar)-7A-methylhexahydroindan-1-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 152.120115134 u
Formula C10H16O
InChI InChI=1S/C10H16O/c1-10-7-3-2-4-8(10)5-6-9(10)11/h8H,2-7H2,1H3/t8-,10-/m1/s1
InChIKey WYKZJZRPDWKUBM-PSASIEDQSA-N
Molecular Weight 152.237 g/mol
SMILES [C@]12(C(CC[C@]2(CCCC1)[H])=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.956642