(S)-6-(4-Chlorobenzyl)-3,4,5,6-tetrahydrocyclopenta[b]-pyran-7(2H)-one

SpectraBase Compound ID	Gc7JSd2wcBK
InChI	InChI=1S/C15H15ClO2/c16-13-5-3-10(4-6-13)8-12-9-11-2-1-7-18-15(11)14(12)17/h3-6,12H,1-2,7-9H2/t12-/m0/s1
InChIKey	XVMZUWHBPGOMPQ-LBPRGKRZSA-N Google Search
Mol Weight	262.74 g/mol
Molecular Formula	C15H15ClO2
Exact Mass	262.076057 g/mol

Subscribe to view the full spectrum.

SpectraBase Spectrum ID	6nt2QetcVZA
Name	(S)-6-(4-Chlorobenzyl)-3,4,5,6-tetrahydrocyclopenta[B]-pyran-7(2H)-one
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	262.076057421 u
Formula	C15H15ClO2
InChI	InChI=1S/C15H15ClO2/c16-13-5-3-10(4-6-13)8-12-9-11-2-1-7-18-15(11)14(12)17/h3-6,12H,1-2,7-9H2/t12-/m0/s1
InChIKey	XVMZUWHBPGOMPQ-LBPRGKRZSA-N
Molecular Weight	262.736 g/mol
SMILES	C12=C(CCCO2)C[C@@](C1=O)(CC=1C=CC(=CC1)Cl)[H]
Spectrum/Structure Validation Score (Vapor Phase IR)	0.802647