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[(1S)-endo]-Bornyl-2-Isopropoxyphenylacetate
SpectraBase Compound ID 4mIawSbbiVf
InChI InChI=1S/C21H30O3/c1-14(2)23-18(15-9-7-6-8-10-15)19(22)24-17-13-16-11-12-21(17,5)20(16,3)4/h6-10,14,16-18H,11-13H2,1-5H3/t16-,17-,18?,21+/m0/s1
InChIKey PAIYDBWQGJVDIF-HJRJXYFPSA-N
Mol Weight 330.47 g/mol
Molecular Formula C21H30O3
Exact Mass 330.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7HHCWI0GlSK
Name [(1S)-endo]-Bornyl-2-Isopropoxyphenylacetate
Alternate Name(s) (1S)-1,7,7-trimethylbicyclo[2.2.1]hept-2-yl (2-isopropoxyphenyl)acetate [(1S)-endo]-Bornyl-2-Isopropoxy-2-phenylacetate
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Formula C21H30O3
InChI InChI=1S/C21H30O3/c1-14(2)23-18(15-9-7-6-8-10-15)19(22)24-17-13-16-11-12-21(17,5)20(16,3)4/h6-10,14,16-18H,11-13H2,1-5H3/t16-,17-,18?,21+/m0/s1
InChIKey PAIYDBWQGJVDIF-HJRJXYFPSA-N
Molecular Weight 330.468 g/mol
SMILES [C@]12(C([C@](C[C@@]2(OC(C(OC(C)C)c2ccccc2)=O)[H])(CC1)[H])(C)C)C
SPLASH splash10-0002-2900000000-3fee206311ba6d1ae3c4
Source of Spectrum J-60-4457-8
Wiley ID 1328283