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1-[3-Hydroxy-3-(4-isopropoxyphenyl)prop-1-ynyl]cyclopentanol
SpectraBase Compound ID 3TIsYMyFCN2
InChI InChI=1S/C17H22O3/c1-13(2)20-15-7-5-14(6-8-15)16(18)9-12-17(19)10-3-4-11-17/h5-8,13,16,18-19H,3-4,10-11H2,1-2H3
InChIKey MLJQABFCOBEUQG-UHFFFAOYSA-N
Mol Weight 274.36 g/mol
Molecular Formula C17H22O3
Exact Mass 274.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K0K1Gm6iSNE
Name 1-[3-Hydroxy-3-(4-isopropoxyphenyl)prop-1-ynyl]cyclopentanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22O3
InChI InChI=1S/C17H22O3/c1-13(2)20-15-7-5-14(6-8-15)16(18)9-12-17(19)10-3-4-11-17/h5-8,13,16,18-19H,3-4,10-11H2,1-2H3
InChIKey MLJQABFCOBEUQG-UHFFFAOYSA-N
Molecular Weight 274.360 g/mol
SMILES OC1(C#CC(c2ccc(OC(C)C)cc2)O)CCCC1
SPLASH splash10-00di-1940000000-6e0659156c4c6134abbf
Source of Spectrum F4-43-2677-5
Wiley ID 1676258