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

*Links on SpectraBase are not permalinks.
2-(3-ketocyclododecyl)malonic acid ditert-butyl ester
SpectraBase Compound ID AEF5bV1wkdE
InChI InChI=1S/C23H40O5/c1-22(2,3)27-20(25)19(21(26)28-23(4,5)6)17-14-12-10-8-7-9-11-13-15-18(24)16-17/h17,19H,7-16H2,1-6H3
InChIKey SZNBKDFDTMSLKD-UHFFFAOYSA-N
Mol Weight 396.6 g/mol
Molecular Formula C23H40O5
Exact Mass 396.287574 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 JDeXfEJ0FKw
Name 2-(3-ketocyclododecyl)malonic acid ditert-butyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H40O5
InChI InChI=1S/C23H40O5/c1-22(2,3)27-20(25)19(21(26)28-23(4,5)6)17-14-12-10-8-7-9-11-13-15-18(24)16-17/h17,19H,7-16H2,1-6H3
InChIKey SZNBKDFDTMSLKD-UHFFFAOYSA-N
Molecular Weight 396.568 g/mol
SMILES C(C(C(OC(C)(C)C)=O)C1CC(=O)CCCCCCCCC1)(OC(C)(C)C)=O
SPLASH splash10-001i-0091000000-72ba80e6930bcb143a4d
Source of Spectrum J-61-3529-0
Synonyms 2-(3-oxocyclododecyl)propanedioic acid ditert-butyl ester ditert-butyl 2-(3-oxidanylidenecyclododecyl)propanedioate ditert-butyl 2-(3-oxocyclododecyl)propanedioate
Wiley ID 1367580