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2-Methyl-5-heptamethylene-4-(2-methylenepropyl)-1,2,4-triazolidin-3-thione
SpectraBase Compound ID 30sx4NA7EXm
InChI InChI=1S/C14H25N3S/c1-5-6-7-8-9-10-13-15-16(4)14(18)17(13)11-12(2)3/h10,15H,2,5-9,11H2,1,3-4H3/b13-10+
InChIKey WSOSKBUHTUIBEP-JLHYYAGUSA-N
Mol Weight 267.43 g/mol
Molecular Formula C14H25N3S
Exact Mass 267.176919 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GJ9W1TCQwBY
Name 2-Methyl-5-heptamethylene-4-(2-methylenepropyl)-1,2,4-triazolidin-3-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H25N3S
InChI InChI=1S/C14H25N3S/c1-5-6-7-8-9-10-13-15-16(4)14(18)17(13)11-12(2)3/h10,15H,2,5-9,11H2,1,3-4H3/b13-10+
InChIKey WSOSKBUHTUIBEP-JLHYYAGUSA-N
Molecular Weight 267.435 g/mol
SMILES N1N(C(N(\C1=C/CCCCCC)CC(=C)C)=S)C
SPLASH splash10-006x-9800000000-c11340bf70d5d675df61
Source of Spectrum O-26-846-11
Synonyms (5Z)-5-heptylidene-2-methyl-4-(2-methyl-2-propenyl)-1,2,4-triazolidine-3-thione
Wiley ID 1271158