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6-(1-Methyltridecyl)-3-methylcaprolactone

View entire compound with spectra: 1 NMR

6-(1-Methyltridecyl)-3-methylcaprolactone
SpectraBase Compound ID 5Hlw29FlSwF
InChI InChI=1S/C21H40O2/c1-4-5-6-7-8-9-10-11-12-13-14-19(3)20-16-15-18(2)17-21(22)23-20/h18-20H,4-17H2,1-3H3/t18-,19?,20?/m0/s1
InChIKey CNZARHKAFFPIKH-HDYDNRTBSA-N
Mol Weight 324.5 g/mol
Molecular Formula C21H40O2
Exact Mass 324.302831 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Lk958s4rrRQ
Name 6-(1-METHYLTRIDECYL)-3-METHYLCAPROLACTONE
Compound Number 1 0B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H40O2
InChI InChI=1S/C21H40O2/c1-4-5-6-7-8-9-10-11-12-13-14-19(3)20-16-15-18(2)17-21(22)23-20/h18-20H,4-17H2,1-3H3/t18-,19?,20?/m0/s1
InChIKey CNZARHKAFFPIKH-HDYDNRTBSA-N
Literature Reference Author D.MILLER,F.BILODEAU,R.H.BURNELL
Literature Reference Citation CAN.J.CHEM.,69,1100(1991)
Literature Reference DOI 10.1139/v91-163
Molecular Weight 324.547 g/mol
Solvent CDCl3
Source File Reference UWTS2458