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1-(4-Chlorophenyl)-7,7-dimethyl-3-[4-(ethyoxycarbonylmethoxy)phenyl]-5-oxo-1,2,3,4,5,6,7,8-octahydroquinazoline
SpectraBase Compound ID 1Rj5QAuwrr6
InChI InChI=1S/C26H29ClN2O4/c1-4-32-25(31)16-33-21-11-9-19(10-12-21)28-15-22-23(13-26(2,3)14-24(22)30)29(17-28)20-7-5-18(27)6-8-20/h5-12H,4,13-17H2,1-3H3
InChIKey NBDYFJNOOFYNOJ-UHFFFAOYSA-N
Mol Weight 468.98 g/mol
Molecular Formula C26H29ClN2O4
Exact Mass 468.181585 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 60Zaqrg88xb
Name 1-(4-Chlorophenyl)-7,7-dimethyl-3-[4-(ethyoxycarbonylmethoxy)phenyl]-5-oxo-1,2,3,4,5,6,7,8-octahydroquinazoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H29ClN2O4
InChI InChI=1S/C26H29ClN2O4/c1-4-32-25(31)16-33-21-11-9-19(10-12-21)28-15-22-23(13-26(2,3)14-24(22)30)29(17-28)20-7-5-18(27)6-8-20/h5-12H,4,13-17H2,1-3H3
InChIKey NBDYFJNOOFYNOJ-UHFFFAOYSA-N
Molecular Weight 468.981 g/mol
SMILES C12=C(N(c3ccc(cc3)Cl)CN(C1)c1ccc(OCC(=O)OCC)cc1)CC(CC2=O)(C)C
SPLASH splash10-0a4i-0090100000-dc3f5fbf38756921f559
Source of Spectrum F2-45-5394-9
Synonyms 2-[4-[1-(4-chlorophenyl)-7,7-dimethyl-5-oxo-2,4,6,8-tetrahydroquinazolin-3-yl]phenoxy]acetic acid ethyl ester Ethyl 2-[4-[1-(4-chlorophenyl)-7,7-dimethyl-5-oxo-2,4,6,8-tetrahydroquinazolin-3-yl]phenoxy]acetate Ethyl 2-[4-[1-(4-chlorophenyl)-7,7-dimethyl-5-oxidanylidene-2,4,6,8-tetrahydroquinazolin-3-yl]phenoxy]ethanoate
Wiley ID 1703628