CID 209327

19730-23-5

Structural Information

Molecular Formula
C11H12ClN3
SMILES
CN(C)C1=C(N(N=C1)C2=CC=CC=C2)Cl
InChI
InChI=1S/C11H12ClN3/c1-14(2)10-8-13-15(11(10)12)9-6-4-3-5-7-9/h3-8H,1-2H3
InChIKey
LUEMPWVBDPMIDZ-UHFFFAOYSA-N
Compound name
5-chloro-N,N-dimethyl-1-phenylpyrazol-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

221.07198 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.07926 147.3
[M+Na]+ 244.06120 157.1
[M-H]- 220.06470 153.1
[M+NH4]+ 239.10580 166.1
[M+K]+ 260.03514 153.2
[M+H-H2O]+ 204.06924 139.1
[M+HCOO]- 266.07018 167.6
[M+CH3COO]- 280.08583 192.6
[M+Na-2H]- 242.04665 152.1
[M]+ 221.07143 150.4
[M]- 221.07253 150.4
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.