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Benzoic acid, 6-[[6-[2-(dimethylamino)ethyl]-4-methoxy-1,3-benzodioxol-5-yl]acetyl]-2,3-dimethoxy-
SpectraBase Compound ID 5ddafbPz09c
InChI InChI=1S/C23H27NO8/c1-24(2)9-8-13-10-18-22(32-12-31-18)20(29-4)15(13)11-16(25)14-6-7-17(28-3)21(30-5)19(14)23(26)27/h6-7,10H,8-9,11-12H2,1-5H3,(H,26,27)
InChIKey DEXMFYZAHXMZNM-UHFFFAOYSA-N
Mol Weight 445.47 g/mol
Molecular Formula C23H27NO8
Exact Mass 445.173667 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 22WQsG6b9lo
Name Narceine
Alternate Name(s) 6-(2-(6-(2-(dimethylamino)ethyl)-4-methoxybenzo[d][1,3]dioxol-5-yl)acetyl)-2,3-dimethoxybenzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H27NO8
InChI InChI=1S/C23H27NO8/c1-24(2)9-8-13-10-18-22(32-12-31-18)20(29-4)15(13)11-16(25)14-6-7-17(28-3)21(30-5)19(14)23(26)27/h6-7,10H,8-9,11-12H2,1-5H3,(H,26,27)
InChIKey DEXMFYZAHXMZNM-UHFFFAOYSA-N
Molecular Weight 445.468 g/mol
SMILES OC(c1c(C(Cc2c(OC)c3c(cc2CCN(C)C)OCO3)=O)ccc(c1OC)OC)=O
SPLASH splash10-0a4i-9110000000-01cf0186b1f008cd1320
Source of Spectrum SWG-33-1943-0
Wiley ID 1809450