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1-(1-Methyl-prop-1-enyl)-3-methylthio-1H-1,2,4-triazole

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1-(1-Methyl-prop-1-enyl)-3-methylthio-1H-1,2,4-triazole
SpectraBase Compound ID 885zI2GyH5X
InChI InChI=1S/C7H11N3S/c1-4-6(2)10-5-8-7(9-10)11-3/h4-5H,1-3H3/b6-4-
InChIKey WIFDFJLBVZLEQZ-XQRVVYSFSA-N
Mol Weight 169.25 g/mol
Molecular Formula C7H11N3S
Exact Mass 169.067369 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DHDwR6b0mvh
Name 1H-1,2,4-triazole, 1-(1-methyl-1-propenyl)-3-(methylthio)-
Alternate Name(s) 1-[(1Z)-1-methyl-1-propenyl]-3-(methylsulfanyl)-1H-1,2,4-triazole Methyl 1-[(1Z)-1-methyl-1-propenyl]-1H-1,2,4-triazol-3-yl sulfide
CAS Registry Number 112390-22-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H11N3S
InChI InChI=1S/C7H11N3S/c1-4-6(2)10-5-8-7(9-10)11-3/h4-5H,1-3H3/b6-4-
InChIKey WIFDFJLBVZLEQZ-XQRVVYSFSA-N
Molecular Weight 169.246 g/mol
SMILES c1(nc[n](n1)\C(=C/C)C)SC
SPLASH splash10-00di-0900000000-68d2580cd57e28c017cf
Source of Spectrum KC-1987-1570-6
Wiley ID 1165652