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1-[2'-(Methylamino)-4'-formylphenyl]-1,4,13-trioxa-7,10-dithia-15-hydroxypentadecane
SpectraBase Compound ID nzxqGRY6mI
InChI InChI=1S/C18H29NO5S2/c1-19-17-14-16(15-21)2-3-18(17)24-7-6-23-9-11-26-13-12-25-10-8-22-5-4-20/h2-3,14-15,19-20H,4-13H2,1H3
InChIKey BRHIOPGOOKBEHN-UHFFFAOYSA-N
Mol Weight 403.55 g/mol
Molecular Formula C18H29NO5S2
Exact Mass 403.148715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3EDgxHyRpBG
Name 1-[2'-(Methylamino)-4'-formylphenyl]-1,4,13-trioxa-7,10-dithia-15-hydroxypentadecane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H29NO5S2
InChI InChI=1S/C18H29NO5S2/c1-19-17-14-16(15-21)2-3-18(17)24-7-6-23-9-11-26-13-12-25-10-8-22-5-4-20/h2-3,14-15,19-20H,4-13H2,1H3
InChIKey BRHIOPGOOKBEHN-UHFFFAOYSA-N
Molecular Weight 403.552 g/mol
SMILES OCCOCCSCCSCCOCCOc1c(cc(cc1)C=O)NC
SPLASH splash10-0udi-1390100000-242e210c5a0f72490256
Source of Spectrum QF-45-651-2
Wiley ID 833457