For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Di-tert-butyl 3-(anilinocarbonyl)-2-methyl-1-cyclobutene-1,4-dicarboxylate
SpectraBase Compound ID 9LgCui4Xp0u
InChI InChI=1S/C22H29NO5/c1-13-15(18(24)23-14-11-9-8-10-12-14)17(20(26)28-22(5,6)7)16(13)19(25)27-21(2,3)4/h8-12,15,17H,1-7H3,(H,23,24)/t15-,17+/m1/s1
InChIKey FNMKHHPFBBDWBZ-WBVHZDCISA-N
Mol Weight 387.48 g/mol
Molecular Formula C22H29NO5
Exact Mass 387.204573 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID AueTAYhb51s
Name Di-tert-butyl 3-(anilinocarbonyl)-2-methyl-1-cyclobutene-1,4-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H29NO5
InChI InChI=1S/C22H29NO5/c1-13-15(18(24)23-14-11-9-8-10-12-14)17(20(26)28-22(5,6)7)16(13)19(25)27-21(2,3)4/h8-12,15,17H,1-7H3,(H,23,24)/t15-,17+/m1/s1
InChIKey FNMKHHPFBBDWBZ-WBVHZDCISA-N
Molecular Weight 387.476 g/mol
SMILES N(C([C@]1([C@@](C(=C1C)C(OC(C)(C)C)=O)(C(OC(C)(C)C)=O)[H])[H])=O)c1ccccc1
SPLASH splash10-000x-9211000000-6f5d9ae412dfa275e281
Source of Spectrum F-55-11857-5
Synonyms (1S,4S)-3-Methyl-4-phenylcarbamoyl-cyclobut-2-ene-1,2-dicarboxylic acid di-tert-butyl ester di(tert-butyl) 4-(anilinocarbonyl)-3-methyl-2-cyclobutene-1,2-dicarboxylate (1S,4S)-4-[anilino(oxo)methyl]-3-methylcyclobut-2-ene-1,2-dicarboxylic acid ditert-butyl ester ditert-butyl (1S,4S)-3-methyl-4-(phenylcarbamoyl)cyclobut-2-ene-1,2-dicarboxylate
Wiley ID 839342