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2-Nitro-3-(5-octoxy-1H-indol-3-yl)pentanoic acid ethyl ester
SpectraBase Compound ID GzGcd4Sdnkf
InChI InChI=1S/C23H34N2O5/c1-4-7-8-9-10-11-14-30-17-12-13-21-19(15-17)20(16-24-21)18(5-2)22(25(27)28)23(26)29-6-3/h12-13,15-16,18,22,24H,4-11,14H2,1-3H3
InChIKey KKOJCUNCJNOZGX-UHFFFAOYSA-N
Mol Weight 418.5 g/mol
Molecular Formula C23H34N2O5
Exact Mass 418.246772 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ISmiUFc8JUg
Name 2-Nitro-3-(5-octoxy-1H-indol-3-yl)pentanoic acid ethyl ester
Alternate Name(s) 2-Nitro-3-(5-octoxy-1H-indol-3-yl)valeric acid ethyl ester Ethyl 2-nitro-3-(5-octoxy-1H-indol-3-yl)pentanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H34N2O5
InChI InChI=1S/C23H34N2O5/c1-4-7-8-9-10-11-14-30-17-12-13-21-19(15-17)20(16-24-21)18(5-2)22(25(27)28)23(26)29-6-3/h12-13,15-16,18,22,24H,4-11,14H2,1-3H3
InChIKey KKOJCUNCJNOZGX-UHFFFAOYSA-N
Molecular Weight 418.534 g/mol
SMILES [nH]1c2ccc(cc2c(c1)C(C(C(=O)OCC)N(=O)=O)CC)OCCCCCCCC
SPLASH splash10-00kr-0890800000-ac1981718ffd9a43c3fe
Source of Spectrum F2-41-2548-7
Wiley ID 1599724