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Benzoic acid, 2-hydroxy-5-(2-propynyloxy)-, 1,10-decanediyl ester
SpectraBase Compound ID KUgvxPVzQci
InChI InChI=1S/C30H34O8/c1-3-17-35-23-13-15-27(31)25(21-23)29(33)37-19-11-9-7-5-6-8-10-12-20-38-30(34)26-22-24(36-18-4-2)14-16-28(26)32/h1-2,13-16,21-22,31-32H,5-12,17-20H2
InChIKey MSZKYAHCZRXNNW-UHFFFAOYSA-N
Mol Weight 522.6 g/mol
Molecular Formula C30H34O8
Exact Mass 522.225368 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7d4QVNmdYA7
Name Benzoic acid, 2-hydroxy-5-(2-propynyloxy)-, 1,10-decanediyl ester
Alternate Name(s) 1,10-Decanediyl bis[2-hydroxy-5-(2-propynyloxy)benzoate] 10-{[2-hydroxy-5-(2-propynyloxy)benzoyl]oxy}decyl 2-hydroxy-5-(2-propynyloxy)benzoate
CAS Registry Number 120296-72-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H34O8
InChI InChI=1S/C30H34O8/c1-3-17-35-23-13-15-27(31)25(21-23)29(33)37-19-11-9-7-5-6-8-10-12-20-38-30(34)26-22-24(36-18-4-2)14-16-28(26)32/h1-2,13-16,21-22,31-32H,5-12,17-20H2
InChIKey MSZKYAHCZRXNNW-UHFFFAOYSA-N
Molecular Weight 522.594 g/mol
SMILES Oc1c(C(OCCCCCCCCCCOC(c2c(ccc(c2)OCC#C)O)=O)=O)cc(cc1)OCC#C
SPLASH splash10-00fr-0900020000-e451c866749f5334be10
Source of Spectrum C-111-3647-8
Wiley ID 1402286