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Tri-O-thymotide

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 MS (GC)

Tri-O-thymotide
SpectraBase Compound ID 54H2UvXQiBw
InChI InChI=1S/C33H36O6/c1-16(2)22-13-10-19(7)25-28(22)37-32(35)26-20(8)11-14-23(17(3)4)29(26)39-33(36)27-21(9)12-15-24(18(5)6)30(27)38-31(25)34/h10-18H,1-9H3
InChIKey ZIKHLMVJGCYVAC-UHFFFAOYSA-N
Mol Weight 528.6 g/mol
Molecular Formula C33H36O6
Exact Mass 528.251189 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID FhkwnqX1xW1
Name Tri-O-thymotide
Source of Sample Aldrich
Catalog Number 345512
CAS Registry Number 4399-52-4
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H36O6
InChI InChI=1S/C33H36O6/c1-16(2)22-13-10-19(7)25-28(22)37-32(35)26-20(8)11-14-23(17(3)4)29(26)39-33(36)27-21(9)12-15-24(18(5)6)30(27)38-31(25)34/h10-18H,1-9H3
InChIKey ZIKHLMVJGCYVAC-UHFFFAOYSA-N
Synonyms Cyclic trilactone of o-thymotic acid
Wiley ID SIAL_ATR-IR_016355