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1-[(E)-[1-(phenylmethyl)pyrazol-4-yl]methylideneamino]urea
SpectraBase Compound ID AlC8JsF7HPx
InChI InChI=1S/C12H13N5O/c13-12(18)16-14-6-11-7-15-17(9-11)8-10-4-2-1-3-5-10/h1-7,9H,8H2,(H3,13,16,18)/b14-6+
InChIKey CZXSJNIQTXJORA-MKMNVTDBSA-N
Mol Weight 243.27 g/mol
Molecular Formula C12H13N5O
Exact Mass 243.11201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Im7hgQNlxaM
Name 1-[(E)-[1-(phenylmethyl)pyrazol-4-yl]methylideneamino]urea
Alternate Name(s) [(E)-(1-benzylpyrazol-4-yl)methyleneamino]urea [(E)-(1-benzylpyrazol-4-yl)methylideneamino]urea [(E)-[1-(phenylmethyl)-4-pyrazolyl]methylideneamino]urea
CAS Registry Number 132549-00-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13N5O
InChI InChI=1S/C12H13N5O/c13-12(18)16-14-6-11-7-15-17(9-11)8-10-4-2-1-3-5-10/h1-7,9H,8H2,(H3,13,16,18)/b14-6+
InChIKey CZXSJNIQTXJORA-MKMNVTDBSA-N
Molecular Weight 243.270 g/mol
SMILES N(C(=O)N)\N=C\c1c[n](nc1)Cc1ccccc1
SPLASH splash10-0006-9110000000-e52b6da2412699ab94c7
Source of Spectrum AH-121-844-0
Wiley ID 1245941