CID 5400005

(z)-n'-(thiophen-2-ylmethylene)-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carbohydrazide

Structural Information

Molecular Formula
C12H12N4OS
SMILES
C1CC2=C(C1)NN=C2C(=O)N/N=C\C3=CC=CS3
InChI
InChI=1S/C12H12N4OS/c17-12(16-13-7-8-3-2-6-18-8)11-9-4-1-5-10(9)14-15-11/h2-3,6-7H,1,4-5H2,(H,14,15)(H,16,17)/b13-7-
InChIKey
RHTNOJVNXRSZGT-QPEQYQDCSA-N
Compound name
N-[(Z)-thiophen-2-ylmethylideneamino]-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

260.07318 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.08046 156.7
[M+Na]+ 283.06240 165.1
[M+NH4]+ 278.10700 164.4
[M+K]+ 299.03634 163.0
[M-H]- 259.06590 159.2
[M+Na-2H]- 281.04785 161.6
[M]+ 260.07263 158.6
[M]- 260.07373 158.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.