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2-APB CS2
SpectraBase Compound ID 5jdjvvJcgYI
InChI InChI=1S/C12H11NOS/c1-9(13-8-15)6-11-7-10-4-2-3-5-12(10)14-11/h2-5,7,9H,6H2,1H3
InChIKey FUGZCMOEKWIQIS-UHFFFAOYSA-N
Mol Weight 217.29 g/mol
Molecular Formula C12H11NOS
Exact Mass 217.056135 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Fbmt23h8lc
Name 2-APB CS2
Classification Benzofurane analog designer drug derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 217.056135151 u
Formula C12H11NOS
InChI InChI=1S/C12H11NOS/c1-9(13-8-15)6-11-7-10-4-2-3-5-12(10)14-11/h2-5,7,9H,6H2,1H3
InChIKey FUGZCMOEKWIQIS-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 217.286 g/mol
Nominal Mass 217 u
Quality 998
Retention Index 1837
SMILES C=12C(C=C(O2)CC(N=C=S)C)=CC=CC1
SPLASH splash10-001i-2910000000-a1fadbf20e063036e82f
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-(1-Benzofuran-2-yl)-2-isothiocyanatopropane
Technique GC/MS
Wiley ID DD2024_019038