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5-(diisopropylcarbamoyl)-1,3-dimethyl-cyclohept-5-ene-1,3-dicarboxylic acid dimethyl ester
SpectraBase Compound ID Y3IjLi2Y23
InChI InChI=1S/C20H33NO5/c1-13(2)21(14(3)4)16(22)15-9-10-19(5,17(23)25-7)12-20(6,11-15)18(24)26-8/h9,13-14H,10-12H2,1-8H3
InChIKey JFCWCHRGUSUZHN-UHFFFAOYSA-N
Mol Weight 367.5 g/mol
Molecular Formula C20H33NO5
Exact Mass 367.235873 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AeBAnx78KNb
Name 5-(diisopropylcarbamoyl)-1,3-dimethyl-cyclohept-5-ene-1,3-dicarboxylic acid dimethyl ester
CAS Registry Number 119039-14-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H33NO5
InChI InChI=1S/C20H33NO5/c1-13(2)21(14(3)4)16(22)15-9-10-19(5,17(23)25-7)12-20(6,11-15)18(24)26-8/h9,13-14H,10-12H2,1-8H3
InChIKey JFCWCHRGUSUZHN-UHFFFAOYSA-N
Molecular Weight 367.486 g/mol
SMILES C(C=1CC(C(=O)OC)(CC(CC1)(C(=O)OC)C)C)(N(C(C)C)C(C)C)=O
SPLASH splash10-0690-4952000000-c8d1a507b9ddc58d9d7a
Source of Spectrum J-54-1653-33
Synonyms 5-[[di(propan-2-yl)amino]-oxomethyl]-1,3-dimethylcyclohept-5-ene-1,3-dicarboxylic acid dimethyl ester Dimethyl 5-(diisopropylcarbamoyl)-1,3-dimethyl-cyclohept-5-ene-1,3-dicarboxylate Dimethyl 5-[di(propan-2-yl)carbamoyl]-1,3-dimethyl-cyclohept-5-ene-1,3-dicarboxylate
Wiley ID 1352562