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2-[(2'-octylcyclopropyl)tridecyl]-4,4-dimethyloxazoline
SpectraBase Compound ID 1EQ8lwK70aZ
InChI InChI=1S/C29H55NO/c1-4-5-6-7-15-18-21-26-24-27(26)22-19-16-13-11-9-8-10-12-14-17-20-23-28-30-29(2,3)25-31-28/h26-27H,4-25H2,1-3H3
InChIKey XXCINLLOYKTWQZ-UHFFFAOYSA-N
Mol Weight 433.8 g/mol
Molecular Formula C29H55NO
Exact Mass 433.428365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bgdt1Er4rDy
Name 2-[(2'-octylcyclopropyl)tridecyl]-4,4-dimethyloxazoline
Alternate Name(s) 4,4-Dimethyl-2-[13-(2-octylcyclopropyl)tridecyl]-4,5-dihydro-1,3-oxazole 4,4-Dimethyl-2-[13-(2-octylcyclopropyl)tridecyl]-5H-oxazole 4,4-Dimethyl-2-[13-(2-octylcyclopropyl)tridecyl]-5H-1,3-oxazole
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Formula C29H55NO
InChI InChI=1S/C29H55NO/c1-4-5-6-7-15-18-21-26-24-27(26)22-19-16-13-11-9-8-10-12-14-17-20-23-28-30-29(2,3)25-31-28/h26-27H,4-25H2,1-3H3
InChIKey XXCINLLOYKTWQZ-UHFFFAOYSA-N
Molecular Weight 433.765 g/mol
SMILES C1(=NC(CO1)(C)C)CCCCCCCCCCCCCC1CC1CCCCCCCC
SPLASH splash10-03fr-0911000000-c1c6a94be928a9e336f5
Source of Spectrum M-35-28-3
Wiley ID 1382755