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2-AMINO-4-BENZOYL-5,5-PENTAMETHYLEN-4,5-DIHYDRO-1,3,4-THIADIAZOLE
SpectraBase Compound ID 7vVcPpROklS
InChI InChI=1S/C14H17N3OS/c15-13-16-17(12(18)11-7-3-1-4-8-11)14(19-13)9-5-2-6-10-14/h1,3-4,7-8H,2,5-6,9-10H2,(H2,15,16)
InChIKey JSNGAFZPCPEASA-UHFFFAOYSA-N
Mol Weight 275.37 g/mol
Molecular Formula C14H17N3OS
Exact Mass 275.109233 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KAMsXrfqn1u
Name 2-Amino-4-benzoyl-5,5-pentamethylen-4,5-dihydro-1,3,4-thiadiazol
Alternate Name(s) (3-amino-4-thia-1,2-diazaspiro[4.5]dec-2-en-1-yl)(phenyl)methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17N3OS
InChI InChI=1S/C14H17N3OS/c15-13-16-17(12(18)11-7-3-1-4-8-11)14(19-13)9-5-2-6-10-14/h1,3-4,7-8H,2,5-6,9-10H2,(H2,15,16)
InChIKey JSNGAFZPCPEASA-UHFFFAOYSA-N
Literature Reference DOI 10.1002/prac.19863280209
Molecular Weight 275.370 g/mol
SMILES NC=1SC2(N(N1)C(c1ccccc1)=O)CCCCC2
SPLASH splash10-0a6r-5920000000-55304f3d45ba3157ceeb
Source of Spectrum JF-328-212-5b
Wiley ID 1791474