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(3S)-3-(1H-Benzotriazol-1-yl)-2,3-dihydro-1H-isoindol-1-one
SpectraBase Compound ID 4dxaReMb2JF
InChI InChI=1S/C14H10N4O/c19-14-10-6-2-1-5-9(10)13(15-14)18-12-8-4-3-7-11(12)16-17-18/h1-8,13H,(H,15,19)/t13-/m0/s1
InChIKey XRTWVIIMSHSQRK-ZDUSSCGKSA-N
Mol Weight 250.26 g/mol
Molecular Formula C14H10N4O
Exact Mass 250.085461 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4HHSdFHgrOM
Name (3S)-3-(1H-Benzotriazol-1-yl)-2,3-dihydro-1H-isoindol-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H10N4O
InChI InChI=1S/C14H10N4O/c19-14-10-6-2-1-5-9(10)13(15-14)18-12-8-4-3-7-11(12)16-17-18/h1-8,13H,(H,15,19)/t13-/m0/s1
InChIKey XRTWVIIMSHSQRK-ZDUSSCGKSA-N
Molecular Weight 250.261 g/mol
SMILES N1C(c2c([C@@]1([n]1nnc3c1cccc3)[H])cccc2)=O
SPLASH splash10-0ue9-3950000000-ddc58bbc9801b16927b5
Source of Spectrum KD-16-879-5
Synonyms (3S)-3-(1H-1,2,3-benzotriazol-1-yl)-2,3-dihydro-1H-isoindol-1-one
Wiley ID 1637469