CID 135679597

N'-((2-ho-1-naphthyl)methylene)-3-(4-meo-ph)-4-me-1h-pyrazole-5-carbohydrazide

Structural Information

Molecular Formula
C23H20N4O3
SMILES
CC1=C(NN=C1C2=CC=C(C=C2)OC)C(=O)N/N=C/C3=C(C=CC4=CC=CC=C43)O
InChI
InChI=1S/C23H20N4O3/c1-14-21(16-7-10-17(30-2)11-8-16)25-26-22(14)23(29)27-24-13-19-18-6-4-3-5-15(18)9-12-20(19)28/h3-13,28H,1-2H3,(H,25,26)(H,27,29)/b24-13+
InChIKey
WYYMTSPMPHWGKV-ZMOGYAJESA-N
Compound name
N-[(E)-(2-hydroxynaphthalen-1-yl)methylideneamino]-3-(4-methoxyphenyl)-4-methyl-1H-pyrazole-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

400.15353 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 401.160806 195.1
[M+Na]+ 423.142748 203.2
[M-H]- 399.146254 203.1
[M+NH4]+ 418.187353 204.7
[M+K]+ 439.116688 196.5
[M+H-H2O]+ 383.150790 184.5
[M+HCOO]- 445.151731 217.3
[M+CH3COO]- 459.167381 204.6
[M+Na-2H]- 421.128196 198.4
[M]+ 400.15298142 197.5
[M]- 400.15407858 197.5
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.