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(R)-1-[(1R,2R,5R)-1-Allyl-2-isopropyl-5-methylcyclopentyl]-3-methylbut-3-en-2-ol
SpectraBase Compound ID L60qa2o6Js4
InChI InChI=1S/C17H30O/c1-7-10-17(11-16(18)13(4)5)14(6)8-9-15(17)12(2)3/h7,12,14-16,18H,1,4,8-11H2,2-3,5-6H3/t14-,15-,16-,17-/m1/s1
InChIKey JDPRMMUXNJKHIJ-QBPKDAKJSA-N
Mol Weight 250.43 g/mol
Molecular Formula C17H30O
Exact Mass 250.229666 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JX5lxXpBfGs
Name (R)-1-[(1R,2R,5R)-1-Allyl-2-isopropyl-5-methylcyclopentyl]-3-methylbut-3-en-2-ol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 250.229665585 u
Formula C17H30O
InChI InChI=1S/C17H30O/c1-7-10-17(11-16(18)13(4)5)14(6)8-9-15(17)12(2)3/h7,12,14-16,18H,1,4,8-11H2,2-3,5-6H3/t14-,15-,16-,17-/m1/s1
InChIKey JDPRMMUXNJKHIJ-QBPKDAKJSA-N
Molecular Weight 250.426 g/mol
SMILES [C@]1([C@](CC[C@]1(C)[H])(C(C)C)[H])(C[C@](C(=C)C)(O)[H])CC=C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.929278