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3-O-[(R)-3',4'-Dihydro-6'-methoxy-2',5',7',8'-tetramethyl-2H-[1]benzopyran-2'-ylcarbonyl]-1,3-dicyclohexyl-urea
SpectraBase Compound ID 8Q1VWIOq43M
InChI InChI=1S/C28H42N2O4/c1-17-18(2)25-23(19(3)24(17)33-5)14-15-28(4,34-25)26(31)20-10-9-13-22(16-20)30-27(32)29-21-11-7-6-8-12-21/h20-22H,6-16H2,1-5H3,(H2,29,30,32)/t20?,22?,28-/m1/s1
InChIKey FQZSYOJXVNIEEF-BLHVWRTFSA-N
Mol Weight 470.7 g/mol
Molecular Formula C28H42N2O4
Exact Mass 470.314458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1uBlay0NCTD
Name 3-O-[(R)-3',4'-Dihydro-6'-methoxy-2',5',7',8'-tetramethyl-2H-[1]benzopyran-2'-ylcarbonyl]-1,3-dicyclohexyl-urea
CAS Registry Number 139658-01-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H42N2O4
InChI InChI=1S/C28H42N2O4/c1-17-18(2)25-23(19(3)24(17)33-5)14-15-28(4,34-25)26(31)20-10-9-13-22(16-20)30-27(32)29-21-11-7-6-8-12-21/h20-22H,6-16H2,1-5H3,(H2,29,30,32)/t20?,22?,28-/m1/s1
InChIKey FQZSYOJXVNIEEF-BLHVWRTFSA-N
Molecular Weight 470.654 g/mol
SMILES N(C(NC1CCCCC1)=O)C1CC(C([C@@]2(Oc3c(c(c(OC)c(c3C)C)C)CC2)C)=O)CCC1
SPLASH splash10-014i-0091200000-8602ec2e1a1ea5e34be1
Source of Spectrum U-1992-545-6
Wiley ID 764147