CID 5403039

3-isopropyl-n'-(1-phenylethylidene)-1h-pyrazole-5-carbohydrazide

Structural Information

Molecular Formula
C15H18N4O
SMILES
CC(C)C1=CC(=NN1)C(=O)N/N=C(\C)/C2=CC=CC=C2
InChI
InChI=1S/C15H18N4O/c1-10(2)13-9-14(18-17-13)15(20)19-16-11(3)12-7-5-4-6-8-12/h4-10H,1-3H3,(H,17,18)(H,19,20)/b16-11+
InChIKey
NLFZDJHJEDTVJV-LFIBNONCSA-N
Compound name
N-[(E)-1-phenylethylideneamino]-5-propan-2-yl-1H-pyrazole-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

270.14807 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.155346 164.6
[M+Na]+ 293.137288 169.6
[M-H]- 269.140794 168.7
[M+NH4]+ 288.181893 179.0
[M+K]+ 309.111228 166.2
[M+H-H2O]+ 253.145330 155.3
[M+HCOO]- 315.146271 186.5
[M+CH3COO]- 329.161921 202.9
[M+Na-2H]- 291.122736 166.4
[M]+ 270.14752142 162.8
[M]- 270.14861858 162.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.