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Caulerpin
SpectraBase Compound ID BOzeJtENRdI
InChI InChI=1S/C24H18N2O4/c1-29-23(27)17-11-15-13-7-3-6-10-20(13)26-22(15)18(24(28)30-2)12-16-14-8-4-5-9-19(14)25-21(16)17/h3-12,25-26H,1-2H3/b15-11-,16-12-,17-11+,18-12+,21-17-,22-18-
InChIKey PVWALMHWUOWPPA-HCOJNGAVSA-N
Mol Weight 398.42 g/mol
Molecular Formula C24H18N2O4
Exact Mass 398.126657 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7jUTru2gBIQ
Name Caulerpin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H18N2O4
InChI InChI=1S/C24H18N2O4/c1-29-23(27)17-11-15-13-7-3-6-10-20(13)26-22(15)18(24(28)30-2)12-16-14-8-4-5-9-19(14)25-21(16)17/h3-12,25-26H,1-2H3/b15-11-,16-12-,17-11+,18-12+,21-17-,22-18-
InChIKey PVWALMHWUOWPPA-HCOJNGAVSA-N
Molecular Weight 398.418 g/mol
SMILES [nH]1c2c(c3\C=C/(c4c(\C=C/(c13)C(=O)OC)c1ccccc1[nH]4)C(=O)OC)cccc2
SPLASH splash10-002b-0149000000-bf807ad752b4bd958bc9
Source of Spectrum X2-55-498-6
Wiley ID 1604411