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2-Methyl-5,7-dihydrothieno[3,4-d]pyrimidine
SpectraBase Compound ID L5WVDAsHwAX
InChI InChI=1S/C7H8N2S/c1-5-8-2-6-3-10-4-7(6)9-5/h2H,3-4H2,1H3
InChIKey XSUYIZJJKIKWFN-UHFFFAOYSA-N
Mol Weight 152.21 g/mol
Molecular Formula C7H8N2S
Exact Mass 152.040819 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EBWSm6zCNCu
Name Pyrimidine <2-methyl-, 5,7-dihydrothieno[3,4-d]->
CAS Registry Number 36267-71-7
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 152.040819440 u
Formula C7H8N2S
InChI InChI=1S/C7H8N2S/c1-5-8-2-6-3-10-4-7(6)9-5/h2H,3-4H2,1H3
InChIKey XSUYIZJJKIKWFN-UHFFFAOYSA-N
Molecular Weight 152.215 g/mol
Number of Peaks 50
RI1 1394
RI2 1073
RI3 1531
RI4 1491
SMILES c1(ncc2c(n1)CSC2)C
SPLASH splash10-0udi-5900000000-dc9cc2bda6c9a7d4e6ea
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Thieno[3,4-d]pyrimidine, 5,7-dihydro-2-methyl-
Wiley ID LM_FFNSC3_1276