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ISOQUINOLINE, 4-(METHYLTHIO)-

View entire compound with spectra: 4 MS (GC)

ISOQUINOLINE, 4-(METHYLTHIO)-
SpectraBase Compound ID 7cS0xa3y26T
InChI InChI=1S/C10H9NS/c1-12-10-7-11-6-8-4-2-3-5-9(8)10/h2-7H,1H3
InChIKey LJJYUBRSIWDHPJ-UHFFFAOYSA-N
Mol Weight 175.25 g/mol
Molecular Formula C10H9NS
Exact Mass 175.04557 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H1iMNhFdVFf
Name ISOQUINOLINE, 4-(METHYLTHIO)-
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 175.045570468 u
Formula C10H9NS
InChI InChI=1S/C10H9NS/c1-12-10-7-11-6-8-4-2-3-5-9(8)10/h2-7H,1H3
InChIKey LJJYUBRSIWDHPJ-UHFFFAOYSA-N
Molecular Weight 175.249 g/mol
Nominal Mass 175 u
Number of Peaks 112
SMILES c12cncc(SC)c1cccc2
SPLASH splash10-01t9-6900000000-e1ca5c952e84061f8491
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany
Wiley ID MVX001579