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2-Hexyl-2,3-dihydrobenzopyran-6-carboxylic Acid 4'-(Dodecyloxy)biphenyl-4-yl Ester
SpectraBase Compound ID 85v1RlhwSV4
InChI InChI=1S/C40H54O4/c1-3-5-7-9-10-11-12-13-14-16-30-42-36-24-18-32(19-25-36)33-20-26-38(27-21-33)44-40(41)35-23-29-39-34(31-35)22-28-37(43-39)17-15-8-6-4-2/h18-21,23-27,29,31,37H,3-17,22,28,30H2,1-2H3
InChIKey VCIRACGXFDBSBJ-UHFFFAOYSA-N
Mol Weight 598.9 g/mol
Molecular Formula C40H54O4
Exact Mass 598.40221 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hb3iYr4UPpb
Name 2-Hexyl-2,3-dihydrobenzopyran-6-carboxylic Acid 4'-(Dodecyloxy)biphenyl-4-yl Ester
Alternate Name(s) 2-Hexyl-3,4-dihydro-2H-1-benzopyran-6-carboxylic acid[4-(4-dodecoxyphenyl)phenyl]ester 2-Hexylchroman-6-carboxylic acid[4-(4-lauryloxyphenyl)phenyl]ester 4'-(dodecyloxy)[1,1'-biphenyl]-4-yl 2-hexyl-6-chromanecarboxylate [4-(4-dodecoxyphenyl)phenyl]2-hexyl-3,4-dihydro-2H-chromene-6-carboxylate [4-(4-dodecoxyphenyl)phenyl]2-hexylchromane-6-carboxylate 2-Hexyl-3,4-dihydro-2H-1-benzopyran-6-carboxylic acid [4-(4-dodecoxyphenyl)phenyl] ester [4-(4-dodecoxyphenyl)phenyl] 2-hexylchromane-6-carboxylate [4-(4-dodecoxyphenyl)phenyl] 2-hexyl-3,4-dihydro-2H-chromene-6-carboxylate
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Formula C40H54O4
InChI InChI=1S/C40H54O4/c1-3-5-7-9-10-11-12-13-14-16-30-42-36-24-18-32(19-25-36)33-20-26-38(27-21-33)44-40(41)35-23-29-39-34(31-35)22-28-37(43-39)17-15-8-6-4-2/h18-21,23-27,29,31,37H,3-17,22,28,30H2,1-2H3
InChIKey VCIRACGXFDBSBJ-UHFFFAOYSA-N
Molecular Weight 598.868 g/mol
SMILES C(c1cc2CCC(Oc2cc1)CCCCCC)(Oc1ccc(cc1)-c1ccc(cc1)OCCCCCCCCCCCC)=O
SPLASH splash10-0002-0090000000-cb67c1cc1c25d60c6864
Source of Spectrum J-59-5935-7
Wiley ID 1410024