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1-Phenyl-1-[4'-(1",4",7",10"-tetraoxa-13"-azacyclopentadec-13"-yl)phenyl]-prop-2-yn-1-ol
SpectraBase Compound ID IlDZWw1l4Jn
InChI InChI=1S/C25H31NO5/c1-2-25(27,22-6-4-3-5-7-22)23-8-10-24(11-9-23)26-12-14-28-16-18-30-20-21-31-19-17-29-15-13-26/h1,3-11,27H,12-21H2
InChIKey APCOTDFQPUWGEF-UHFFFAOYSA-N
Mol Weight 425.53 g/mol
Molecular Formula C25H31NO5
Exact Mass 425.220223 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3vzaV2BVXU
Name 1-Phenyl-1-[4'-(1",4",7",10"-tetraoxa-13"-azacyclopentadec-13"-yl)phenyl]-prop-2-yn-1-ol
Alternate Name(s) 1-Phenyl-1-[4-(1,4,7,10-tetraoxa-13-azacyclopentadecan-13-yl)phenyl]-2-propyn-1-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H31NO5
InChI InChI=1S/C25H31NO5/c1-2-25(27,22-6-4-3-5-7-22)23-8-10-24(11-9-23)26-12-14-28-16-18-30-20-21-31-19-17-29-15-13-26/h1,3-11,27H,12-21H2
InChIKey APCOTDFQPUWGEF-UHFFFAOYSA-N
Molecular Weight 425.525 g/mol
SMILES OC(C#C)(c1ccc(N2CCOCCOCCOCCOCC2)cc1)c1ccccc1
SPLASH splash10-0c31-3492100000-8cd1131998657e87b581
Source of Spectrum Y2-27-1729-4
Wiley ID 1547458