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Azacyclotetradeca-1,3,5,11,13-pentaene-7,9-diyne, 2-ethoxy-6,11,14-trimethyl-, (E,E,E,Z,Z)-
SpectraBase Compound ID HCQSyrLcmo7
InChI InChI=1S/C18H19NO/c1-5-20-18-12-8-11-15(2)9-6-7-10-16(3)13-14-17(4)19-18/h8,11-14H,5H2,1-4H3/b11-8-,12-8-,14-13-,15-11-,16-13-,17-14-,18-12+,19-17-,19-18+
InChIKey NGRKAOOXVONPOY-PHMAKACYSA-N
Mol Weight 265.36 g/mol
Molecular Formula C18H19NO
Exact Mass 265.146664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6INtcPzkybK
Name Azacyclotetradeca-1,3,5,11,13-pentaene-7,9-diyne, 2-ethoxy-6,11,14-trimethyl-, (E,E,E,Z,Z)-
Alternate Name(s) 14-Ethoxy-2,5,10-trimethyl-6,8-bisdehydroaza[14]anulene 2-ethoxy-6,11,14-trimethylazacyclotetradeca-1,3,5,11,13-pentaene-7,9-diyne ethyl 6,11,14-trimethylazacyclotetradeca-1,3,5,11,13-pentaene-7,9-diyn-2-yl ether
CAS Registry Number 104531-42-2
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H19NO
InChI InChI=1S/C18H19NO/c1-5-20-18-12-8-11-15(2)9-6-7-10-16(3)13-14-17(4)19-18/h8,11-14H,5H2,1-4H3/b11-8-,12-8-,14-13-,15-11-,16-13-,17-14-,18-12+,19-17-,19-18+
InChIKey NGRKAOOXVONPOY-PHMAKACYSA-N
Molecular Weight 265.356 g/mol
SMILES C#1\C(=C/C=C\C(=N/C(=C\C=C/(C#CC1)C)C)OCC)C
SPLASH splash10-0aor-0090000000-23e5b81ac9e2cc64db45
Source of Spectrum AJ-59-1797-3
Wiley ID 1269255