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Methyl 4'-Chloro-6-cyano-4-hexyl-3-hydroxybiphenyl-2-carboxylate

View entire compound with spectra: 1 MS (GC)

Methyl 4'-Chloro-6-cyano-4-hexyl-3-hydroxybiphenyl-2-carboxylate
SpectraBase Compound ID 8Q72OfxYTYO
InChI InChI=1S/C21H22ClNO3/c1-3-4-5-6-7-15-12-16(13-23)18(14-8-10-17(22)11-9-14)19(20(15)24)21(25)26-2/h8-12,24H,3-7H2,1-2H3
InChIKey URKDMEINTHBHPN-UHFFFAOYSA-N
Mol Weight 371.86 g/mol
Molecular Formula C21H22ClNO3
Exact Mass 371.128821 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GDkYMLnl2O5
Name Methyl 4'-Chloro-6-cyano-4-hexyl-3-hydroxybiphenyl-2-carboxylate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22ClNO3
InChI InChI=1S/C21H22ClNO3/c1-3-4-5-6-7-15-12-16(13-23)18(14-8-10-17(22)11-9-14)19(20(15)24)21(25)26-2/h8-12,24H,3-7H2,1-2H3
InChIKey URKDMEINTHBHPN-UHFFFAOYSA-N
Molecular Weight 371.864 g/mol
SMILES Oc1c(c(c(C#N)cc1CCCCCC)-c1ccc(cc1)Cl)C(=O)OC
SPLASH splash10-001i-0195000000-b68cf2e84473026cd18a
Source of Spectrum F4-41-1629-4q
Wiley ID 1672330