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[1,2,3,4,5,6,7,8,9,10-decahydro-1,4-epoxybenzocycloocten-2-yl)methyl] (1R,1'S,2R,4S)-(-)-camphanoate
SpectraBase Compound ID FJyNLrMEHdh
InChI InChI=1S/C23H32O5/c1-20(2)21(3)12-13-23(20,28-18(21)24)19(25)26-14-22-11-10-17(27-22)15-8-6-4-5-7-9-16(15)22/h17H,4-14H2,1-3H3/t17?,21-,22-,23+/m1/s1
InChIKey RGWUMNUILASWTP-PBAVLDNTSA-N
Mol Weight 388.5 g/mol
Molecular Formula C23H32O5
Exact Mass 388.224974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FuY2L9QRNsM
Name [1,2,3,4,5,6,7,8,9,10-decahydro-1,4-epoxybenzocycloocten-2-yl)methyl] (1R,1'S,2R,4S)-(-)-camphanoate
Alternate Name(s) (1S)-13-oxatricyclo[8.2.1.0(2,9)]tridec-2(9)-en-1-ylmethyl (1R,4S)-4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxylate
CAS Registry Number 114379-55-4
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H32O5
InChI InChI=1S/C23H32O5/c1-20(2)21(3)12-13-23(20,28-18(21)24)19(25)26-14-22-11-10-17(27-22)15-8-6-4-5-7-9-16(15)22/h17H,4-14H2,1-3H3/t17?,21-,22-,23+/m1/s1
InChIKey RGWUMNUILASWTP-PBAVLDNTSA-N
Molecular Weight 388.504 g/mol
SMILES [C@]12(OC(=O)[C@@](C2(C)C)(C)CC1)C(OC[C@]12C3=C(CCCCCC3)C(O1)CC2)=O
SPLASH splash10-0udi-0900000000-e973f297897915a6c857
Source of Spectrum K-121-1630-0
Wiley ID 1363966