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trans-5-[2-(dimethyl-d6-amino)vinyl]-1-phenyl-1H-tetrazole
SpectraBase Compound ID JPhuXiDZSMT
InChI InChI=1S/C11H13N5/c1-15(2)9-8-11-12-13-14-16(11)10-6-4-3-5-7-10/h3-9H,1-2H3/b9-8+/i1D3,2D3
InChIKey YSIJXBPCNIAXEQ-VBOXAAFKSA-N
Mol Weight 221.3 g/mol
Molecular Formula C11H7D6N5
Exact Mass 221.154756 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3oXjv0YWKuO
Name Ethen-1-d-amine, N,N-di(methyl-D3)-2-(1-phenyl-1H-tetrazol-5-yl)-, (E)-
CAS Registry Number 125967-12-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H7D6N5
InChI InChI=1S/C11H13N5/c1-15(2)9-8-11-12-13-14-16(11)10-6-4-3-5-7-10/h3-9H,1-2H3/b9-8+/i1D3,2D3
InChIKey YSIJXBPCNIAXEQ-VBOXAAFKSA-N
Molecular Weight 221.297 g/mol
SMILES c1([n](nnn1)-c1ccccc1)\C=C\N(C([2D])([2D])[2D])C([2D])([2D])[2D]
SPLASH splash10-002n-9310000000-45b0501e5511577de9bf
Source of Spectrum O-24-825-1
Synonyms 1-Phenyl-5-[2-(hexadeuterio)dimethylaminovinyl]-1H-tetrazole 1-Phenyl-5-[2-{dimethylamino-(1-deuterio)vinyl}]-1H-tetrazole
Wiley ID 1214510