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3-[(Diallylamino)methyl]-1,3-benzoxazole-2(3H)-thione
SpectraBase Compound ID EWN91bIQ58D
InChI InChI=1S/C14H16N2OS/c1-3-9-15(10-4-2)11-16-12-7-5-6-8-13(12)17-14(16)18/h3-8H,1-2,9-11H2
InChIKey LSCLMNBSNSSBBU-UHFFFAOYSA-N
Mol Weight 260.35 g/mol
Molecular Formula C14H16N2OS
Exact Mass 260.098334 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BYwzLNMXvBq
Name 3-[(Diallylamino)methyl]-1,3-benzoxazole-2(3H)-thione
CAS Registry Number 339064-71-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16N2OS
InChI InChI=1S/C14H16N2OS/c1-3-9-15(10-4-2)11-16-12-7-5-6-8-13(12)17-14(16)18/h3-8H,1-2,9-11H2
InChIKey LSCLMNBSNSSBBU-UHFFFAOYSA-N
Molecular Weight 260.355 g/mol
SMILES c1ccc2N(C(Oc2c1)=S)CN(CC=C)CC=C
SPLASH splash10-0006-9100000000-41ef8e70a641e969bad0
Source of Spectrum AD-0-2532-0
Synonyms 3-[(diallylamino)methyl]-1,3-benzoxazole-2-thione 3-[[bis(prop-2-enyl)amino]methyl]-1,3-benzoxazole-2-thione Benzoxazol, 2,3-dihydro-2-thioxo-3-diallylaminomethyl-
Wiley ID 1421437