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1-Chloroisoquinolin-4-yl-4-(Hexadecyoxy)benzoate

View entire compound with spectra: 1 MS (GC)

1-Chloroisoquinolin-4-yl-4-(Hexadecyoxy)benzoate
SpectraBase Compound ID 4trTVqK2seX
InChI InChI=1S/C32H42ClNO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-24-36-27-22-20-26(21-23-27)32(35)37-30-25-34-31(33)29-19-16-15-18-28(29)30/h15-16,18-23,25H,2-14,17,24H2,1H3
InChIKey JNIJEIWQHPOKMT-UHFFFAOYSA-N
Mol Weight 524.1 g/mol
Molecular Formula C32H42ClNO3
Exact Mass 523.285322 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HqXq9Ku1lc0
Name 1-Chloroisoquinolin-4-yl-4-(Hexadecyoxy)benzoate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H42ClNO3
InChI InChI=1S/C32H42ClNO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-24-36-27-22-20-26(21-23-27)32(35)37-30-25-34-31(33)29-19-16-15-18-28(29)30/h15-16,18-23,25H,2-14,17,24H2,1H3
InChIKey JNIJEIWQHPOKMT-UHFFFAOYSA-N
Molecular Weight 524.145 g/mol
SMILES C(Oc1c2c(cccc2)c(nc1)Cl)(c1ccc(cc1)OCCCCCCCCCCCCCCCC)=O
SPLASH splash10-0002-0309010000-0b0e3ad6da7dc633d114
Source of Spectrum H-92-2029-6b
Wiley ID 1693758