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2-(2-Ethoxy-4-hydroxypent-1-enyl)-1-tosylindoline
SpectraBase Compound ID FqJ37e5NU4w
InChI InChI=1S/C22H27NO4S/c1-4-27-20(13-17(3)24)15-19-14-18-7-5-6-8-22(18)23(19)28(25,26)21-11-9-16(2)10-12-21/h5-12,15,17,19,24H,4,13-14H2,1-3H3/b20-15-
InChIKey CJJQTYMOMQRTPV-HKWRFOASSA-N
Mol Weight 401.52 g/mol
Molecular Formula C22H27NO4S
Exact Mass 401.16608 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7JdU7klAlKw
Name 2-(2-Ethoxy-4-hydroxypent-1-enyl)-1-tosylindoline
Alternate Name(s) (Z)-4-ethoxy-5-(1-tosylindolin-2-yl)pent-4-en-2-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H27NO4S
InChI InChI=1S/C22H27NO4S/c1-4-27-20(13-17(3)24)15-19-14-18-7-5-6-8-22(18)23(19)28(25,26)21-11-9-16(2)10-12-21/h5-12,15,17,19,24H,4,13-14H2,1-3H3/b20-15-
InChIKey CJJQTYMOMQRTPV-HKWRFOASSA-N
Molecular Weight 401.521 g/mol
SMILES OC(C\C(=C\C1N(S(c2ccc(cc2)C)(=O)=O)c2c(cccc2)C1)OCC)C
SPLASH splash10-0ue9-2793000000-3d426df21ce12dacee5c
Source of Spectrum J-2013-6995-2g
Wiley ID 1743444