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1H-Isoindole-1,3(2H)-dione, N-[2-(1H-1,2,4-triazol-3-yl)ethyl]-
SpectraBase Compound ID 8bFa0NM0NU4
InChI InChI=1S/C12H10N4O2/c17-11-8-3-1-2-4-9(8)12(18)16(11)6-5-10-13-7-14-15-10/h1-4,7H,5-6H2,(H,13,14,15)
InChIKey WHEIJIKNGKDPGB-UHFFFAOYSA-N
Mol Weight 242.24 g/mol
Molecular Formula C12H10N4O2
Exact Mass 242.080376 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hisa4W7ADu0
Name 1H-Isoindole-1,3(2H)-dione, N-[2-(1H-1,2,4-triazol-3-yl)ethyl]-
Alternate Name(s) 2-[2-(1H-1,2,4-Triazol-3-yl)ethyl]-1H-isoindole-1,3(2H)-dione 2-[2-(1H-1,2,4-triazol-5-yl)ethyl]isoindole-1,3-dione 2-[2-(1H-1,2,4-triazol-5-yl)ethyl]isoindoline-1,3-dione 2-[2-(1H-1,2,4-triazol-5-yl)ethyl]isoindoline-1,3-quinone
CAS Registry Number 99878-30-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10N4O2
InChI InChI=1S/C12H10N4O2/c17-11-8-3-1-2-4-9(8)12(18)16(11)6-5-10-13-7-14-15-10/h1-4,7H,5-6H2,(H,13,14,15)
InChIKey WHEIJIKNGKDPGB-UHFFFAOYSA-N
Molecular Weight 242.238 g/mol
SMILES [nH]1cnc(n1)CCN1C(c2ccccc2C1=O)=O
SPLASH splash10-03di-3930000000-d4d917b7355aa6ef7358
Wiley ID 1455672