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(3R,4R,7R)-3,7,9-trimethyl-1-decen-4-ol
SpectraBase Compound ID 549CoMkgg8o
InChI InChI=1S/C13H26O/c1-6-12(5)13(14)8-7-11(4)9-10(2)3/h6,10-14H,1,7-9H2,2-5H3/t11-,12-,13-/m1/s1
InChIKey NSKYJMJEZZAIDK-JHJVBQTASA-N
Mol Weight 198.35 g/mol
Molecular Formula C13H26O
Exact Mass 198.198365 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID InQDPBBUhfE
Name (3R,4R,7R)-3,7,9-Trimethyl-1-decen-4-ol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 198.198365456 u
Formula C13H26O
InChI InChI=1S/C13H26O/c1-6-12(5)13(14)8-7-11(4)9-10(2)3/h6,10-14H,1,7-9H2,2-5H3/t11-,12-,13-/m1/s1
InChIKey NSKYJMJEZZAIDK-JHJVBQTASA-N
Molecular Weight 198.350 g/mol
SMILES CC(C)C[C@@](CC[C@]([C@](C)(C=C)[H])(O)[H])(C)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.833161