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1-Chloro-4-(octdecyloxy)isoquinoline

View entire compound with spectra: 1 MS (GC)

1-Chloro-4-(octdecyloxy)isoquinoline
SpectraBase Compound ID 3lR7Rpc9K2c
InChI InChI=1S/C27H42ClNO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22-30-26-23-29-27(28)25-21-18-17-20-24(25)26/h17-18,20-21,23H,2-16,19,22H2,1H3
InChIKey XLPXDXRFPSIOCQ-UHFFFAOYSA-N
Mol Weight 432.1 g/mol
Molecular Formula C27H42ClNO
Exact Mass 431.295493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Nxoxnzb9uH
Name 1-Chloro-4-(octdecyloxy)isoquinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H42ClNO
InChI InChI=1S/C27H42ClNO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22-30-26-23-29-27(28)25-21-18-17-20-24(25)26/h17-18,20-21,23H,2-16,19,22H2,1H3
InChIKey XLPXDXRFPSIOCQ-UHFFFAOYSA-N
Molecular Weight 432.092 g/mol
SMILES c1(ncc(c2ccccc12)OCCCCCCCCCCCCCCCCCC)Cl
SPLASH splash10-002b-0809200000-494bed166e9bcc9aec07
Source of Spectrum F4-40-2555-19m
Wiley ID 1670841