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[3-(([(2E)-3-Phenyl-2-propenoyl]oxy)methyl)-1-adamantyl]methyl (2E)-3-phenyl-2-propenoate
SpectraBase Compound ID JSYCh34GEkb
InChI InChI=1S/C30H32O4/c31-27(13-11-23-7-3-1-4-8-23)33-21-29-16-25-15-26(17-29)19-30(18-25,20-29)22-34-28(32)14-12-24-9-5-2-6-10-24/h1-14,25-26H,15-22H2/b13-11+,14-12+/t25-,26+,29+,30-
InChIKey NNUCBBWYDHDDPG-FOPQHWNJSA-N
Mol Weight 456.6 g/mol
Molecular Formula C30H32O4
Exact Mass 456.23006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8cldn6BW4oS
Name [3-(([(2E)-3-Phenyl-2-propenoyl]oxy)methyl)-1-adamantyl]methyl (2E)-3-phenyl-2-propenoate
Alternate Name(s) 1,3-Bis(cinnamoyloxymethyl)adamantane [3-[[(E)-3-phenylprop-2-enoyl]oxymethyl]-1-adamantyl]methyl (E)-3-phenylprop-2-enoate (E)-3-phenyl-2-propenoic acid [3-[[(E)-1-oxo-3-phenylprop-2-enoxy]methyl]-1-adamantyl]methyl ester
CAS Registry Number 303797-58-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H32O4
InChI InChI=1S/C30H32O4/c31-27(13-11-23-7-3-1-4-8-23)33-21-29-16-25-15-26(17-29)19-30(18-25,20-29)22-34-28(32)14-12-24-9-5-2-6-10-24/h1-14,25-26H,15-22H2/b13-11+,14-12+/t25-,26+,29+,30-
InChIKey NNUCBBWYDHDDPG-FOPQHWNJSA-N
Molecular Weight 456.582 g/mol
SMILES [C@]12(C[C@@]3(C[C@](C2)(C[C@](C1)(C3)[H])COC(=O)\C=C\c1ccccc1)COC(=O)\C=C\c1ccccc1)[H]
SPLASH splash10-0fal-8900000000-50f53d84c5e799a4b062
Wiley ID 1470515