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2-Cyclopenten-1-one, 4-(benzoyloxy)-2-(1,3-dithian-2-ylmethyl)-, (R)-
SpectraBase Compound ID 5sXjYvICXzR
InChI InChI=1S/C17H18O3S2/c18-15-11-14(20-17(19)12-5-2-1-3-6-12)9-13(15)10-16-21-7-4-8-22-16/h1-3,5-6,9,14,16H,4,7-8,10-11H2/t14-/m0/s1
InChIKey ZLUNOOKGMBOUSI-AWEZNQCLSA-N
Mol Weight 334.45 g/mol
Molecular Formula C17H18O3S2
Exact Mass 334.069737 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FTqkxpLq9an
Name 2-Cyclopenten-1-one, 4-(benzoyloxy)-2-(1,3-dithian-2-ylmethyl)-, (R)-
Alternate Name(s) (1R)-3-(1,3-dithian-2-ylmethyl)-4-oxo-2-cyclopenten-1-yl benzoate (R)-4-benzoyloxy-2-[(1',3'-dithian-2'-yl)methyl]cyclopent-2-enone
CAS Registry Number 132063-90-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18O3S2
InChI InChI=1S/C17H18O3S2/c18-15-11-14(20-17(19)12-5-2-1-3-6-12)9-13(15)10-16-21-7-4-8-22-16/h1-3,5-6,9,14,16H,4,7-8,10-11H2/t14-/m0/s1
InChIKey ZLUNOOKGMBOUSI-AWEZNQCLSA-N
Molecular Weight 334.448 g/mol
SMILES C=1(C(C[C@](C1)(OC(=O)c1ccccc1)[H])=O)CC1SCCCS1
SPLASH splash10-07w9-0934000000-207b54e51c0416149d96
Source of Spectrum KC-1990-2869-12
Wiley ID 1330797