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4,2-cresotic acid, p-(hexyloxy)phenyl ester, p-butylbenzoate
SpectraBase Compound ID 1E3s9eJPV8I
InChI InChI=1S/C31H36O5/c1-4-6-8-9-21-34-26-15-17-27(18-16-26)35-31(33)29-20-19-28(22-23(29)3)36-30(32)25-13-11-24(12-14-25)10-7-5-2/h11-20,22H,4-10,21H2,1-3H3
InChIKey SWHQSVLGNOOYHZ-UHFFFAOYSA-N
Mol Weight 488.6 g/mol
Molecular Formula C31H36O5
Exact Mass 488.256274 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID AoBd8PvP6nq
Name 4,2-CRESOTIC ACID, p-(HEXYLOXY)PHENYL ESTER, p-BUTYLBENZOATE
Source of Sample K. Ritvay-Emandity, Hungarian Academy of Sciences, Budapest, Hungary
Clear Point 135.5C
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H36O5
InChI InChI=1S/C31H36O5/c1-4-6-8-9-21-34-26-15-17-27(18-16-26)35-31(33)29-20-19-28(22-23(29)3)36-30(32)25-13-11-24(12-14-25)10-7-5-2/h11-20,22H,4-10,21H2,1-3H3
InChIKey SWHQSVLGNOOYHZ-UHFFFAOYSA-N
Literature Reference Abstract-Chemical Abstracts= 83, 27821(1975)
Melting Point 71.5C
Molecular Weight 488.623993
Synonyms 4,2-CRESOTIC ACID, P-/HEXYLOXY/PHENYL ESTER, P-BUTYLBENZOATE O-TOLUIC ACID, 4-HYDROXY-, P-/HEXYL- OXY/PHENYL ESTER, P-BUTYLBENZOATE 4-HYDROXY-o-TOLUIC ACID, p-(HEXYLOXY)PHENYL ESTER, p-BUTYLBENZOATE
Technique FILM (CAST FROM CHCl3)