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Tetracyclo[3.2.0.0(2,7).0(4,6)]heptane-1-methanol, .alpha.-methyl-, stereoisomer
SpectraBase Compound ID BNwAeKXMFp9
InChI InChI=1S/C9H12O/c1-3(10)9-5-2-4-6(7(4)9)8(5)9/h3-8,10H,2H2,1H3
InChIKey RJEPHOOANNFVCA-UHFFFAOYSA-N
Mol Weight 136.19 g/mol
Molecular Formula C9H12O
Exact Mass 136.088815 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HtttT8Yns9
Name Tetracyclo[3.2.0.0(2,7).0(4,6)]heptane-1-methanol, .alpha.-methyl-, stereoisomer
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 136.088815005 u
Formula C9H12O
InChI InChI=1S/C9H12O/c1-3(10)9-5-2-4-6(7(4)9)8(5)9/h3-8,10H,2H2,1H3
InChIKey RJEPHOOANNFVCA-UHFFFAOYSA-N
Molecular Weight 136.194 g/mol
SMILES C12(C3C4CC2C1C34)C(O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.844021