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(1S)-1-[(1S,2S)-2-(4-methoxyphenyl)cyclopropyl]prop-2-yn-1-ol
SpectraBase Compound ID F00LMywBSof
InChI InChI=1S/C13H14O2/c1-3-13(14)12-8-11(12)9-4-6-10(15-2)7-5-9/h1,4-7,11-14H,8H2,2H3/t11-,12+,13-/m1/s1
InChIKey IYFPNTAFASVQSC-FRRDWIJNSA-N
Mol Weight 202.25 g/mol
Molecular Formula C13H14O2
Exact Mass 202.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LwXcGxVmizg
Name (1S)-1-[(1S,2S)-2-(4-methoxyphenyl)cyclopropyl]prop-2-yn-1-ol
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O2
InChI InChI=1S/C13H14O2/c1-3-13(14)12-8-11(12)9-4-6-10(15-2)7-5-9/h1,4-7,11-14H,8H2,2H3/t11-,12+,13-/m1/s1
InChIKey IYFPNTAFASVQSC-FRRDWIJNSA-N
Instrument Name TSQ 8000 Evo
Ionization Type EI
Literature Reference DOI 10.1002/anie.202000119
Molecular Weight 202.253 g/mol
SMILES O[C@@]([C@@]1([C@@](c2ccc(cc2)OC)(C1)[H])[H])(C#C)[H]
SPLASH splash10-0002-0910000000-e0c9bbd66acbc433b2ec
Sample Comments dr = 1:1
Source of Spectrum ACI-59-SM67-2bf
Wiley ID 1857706