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2-[3',6',9',12',15'-Pentaoxa-18'-aza-cyclooctadecan-18'-yl]-4-methyl-7-(N.N-dipropyl)amino]-coumarin
SpectraBase Compound ID 7d5UZ2fcEZ0
InChI InChI=1S/C27H42N2O7/c1-4-29(5-2)23-6-7-24-22(3)25(27(30)36-26(24)20-23)21-28-8-10-31-12-14-33-16-18-35-19-17-34-15-13-32-11-9-28/h6-7,20H,4-5,8-19,21H2,1-3H3
InChIKey MQYCEEVQPYFVNJ-UHFFFAOYSA-N
Mol Weight 506.6 g/mol
Molecular Formula C27H42N2O7
Exact Mass 506.299202 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IuR4SSiWDXU
Name 2-[3',6',9',12',15'-Pentaoxa-18'-aza-cyclooctadecan-18'-yl]-4-methyl-7-(N.N-dipropyl)amino]-coumarin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H42N2O7
InChI InChI=1S/C27H42N2O7/c1-4-29(5-2)23-6-7-24-22(3)25(27(30)36-26(24)20-23)21-28-8-10-31-12-14-33-16-18-35-19-17-34-15-13-32-11-9-28/h6-7,20H,4-5,8-19,21H2,1-3H3
InChIKey MQYCEEVQPYFVNJ-UHFFFAOYSA-N
Molecular Weight 506.640 g/mol
SMILES C=1(C(Oc2c(C1C)ccc(N(CC)CC)c2)=O)CN1CCOCCOCCOCCOCCOCC1
SPLASH splash10-0006-9230000000-532f8b97463d1c393678
Source of Spectrum F1-344-203-0
Wiley ID 1559770