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dithio-3-(tetrahydro-3H-azepin-2yl)carbazic acid, methyl ester
SpectraBase Compound ID 69FaC4Ha0qG
InChI InChI=1S/C8H15N3S2/c1-13-8(12)11-10-7-5-3-2-4-6-9-7/h2-6H2,1H3,(H,9,10)(H,11,12)
InChIKey RXQXXGTXRWRWGF-UHFFFAOYSA-N
Mol Weight 217.35 g/mol
Molecular Formula C8H15N3S2
Exact Mass 217.07074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5rCGrtAK6ag
Name Methyl 2-(3,4,5,6-tetrahydro-2H-azepin-7-yl)hydrazinecarbodithioate
CAS Registry Number 18596-83-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H15N3S2
InChI InChI=1S/C8H15N3S2/c1-13-8(12)11-10-7-5-3-2-4-6-9-7/h2-6H2,1H3,(H,9,10)(H,11,12)
InChIKey RXQXXGTXRWRWGF-UHFFFAOYSA-N
Molecular Weight 217.349 g/mol
SMILES N(C(=S)SC)NC=1CCCCCN1
SPLASH splash10-052e-9100000000-29edd5278fd106d713be
Source of Spectrum K-125-1391-4
Synonyms Methyl N-(3,4,5,6-tetrahydro-2H-azepin-7-ylamino)carbamodithioate N-(3,4,5,6-tetrahydro-2H-azepin-7-ylamino)carbamodithioic acid methyl ester
Wiley ID 1216289