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

*Links on SpectraBase are not permalinks.

[(2S,3S)-1,2,3,4-Teytrahydro-1,1,3,4,4,6,7-heptamethylnaphthalene-2-yl]methyl 4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxylate

View entire compound with spectra: 1 MS (GC)

[(2S,3S)-1,2,3,4-Teytrahydro-1,1,3,4,4,6,7-heptamethylnaphthalene-2-yl]methyl 4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxylate
SpectraBase Compound ID AJeaedpluA9
InChI InChI=1S/C28H40O4/c1-16-13-19-20(14-17(16)2)25(6,7)21(18(3)24(19,4)5)15-31-23(30)28-12-11-27(10,22(29)32-28)26(28,8)9/h13-14,18,21H,11-12,15H2,1-10H3/t18-,21-,27-,28+/m0/s1
InChIKey JIIULSCQXBSPOS-HZLOTIRFSA-N
Mol Weight 440.6 g/mol
Molecular Formula C28H40O4
Exact Mass 440.29266 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 4LsoVZxhCtk
Name [(2S,3S)-1,2,3,4-Teytrahydro-1,1,3,4,4,6,7-heptamethylnaphthalene-2-yl]methyl 4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H40O4
InChI InChI=1S/C28H40O4/c1-16-13-19-20(14-17(16)2)25(6,7)21(18(3)24(19,4)5)15-31-23(30)28-12-11-27(10,22(29)32-28)26(28,8)9/h13-14,18,21H,11-12,15H2,1-10H3/t18-,21-,27-,28+/m0/s1
InChIKey JIIULSCQXBSPOS-HZLOTIRFSA-N
Molecular Weight 440.624 g/mol
SMILES [C@@]12(OC(=O)[C@](C2(C)C)(C)CC1)C(OC[C@@]1(C(c2cc(C)c(cc2C([C@]1(C)[H])(C)C)C)(C)C)[H])=O
SPLASH splash10-004i-0690000000-3dba84644d33c003ce15
Source of Spectrum H-85-541-22
Wiley ID 1524085