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(1R,2R)-2-Methyl-3-oxocyclopentanecarbaldehyde

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

(1R,2R)-2-Methyl-3-oxocyclopentanecarbaldehyde
SpectraBase Compound ID CrlmpM73w1h
InChI InChI=1S/C7H10O2/c1-5-6(4-8)2-3-7(5)9/h4-6H,2-3H2,1H3/t5-,6+/m1/s1
InChIKey PORSLRXAINXJMJ-RITPCOANSA-N
Mol Weight 126.15 g/mol
Molecular Formula C7H10O2
Exact Mass 126.06808 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JVWHFz8fccf
Name (1R,2R)-2-Methyl-3-oxocyclopentanecarbaldehyde
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 126.068079560 u
Formula C7H10O2
InChI InChI=1S/C7H10O2/c1-5-6(4-8)2-3-7(5)9/h4-6H,2-3H2,1H3/t5-,6+/m1/s1
InChIKey PORSLRXAINXJMJ-RITPCOANSA-N
Molecular Weight 126.155 g/mol
SMILES C1([C@@]([C@](C=O)(CC1)[H])(C)[H])=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.950019