CID 200270

1h-indazole, 3-(2-(dimethylamino)ethoxy)-1-methyl-, monohydrochloride

Structural Information

Molecular Formula
C12H17N3O
SMILES
CN1C2=CC=CC=C2C(=N1)OCCN(C)C
InChI
InChI=1S/C12H17N3O/c1-14(2)8-9-16-12-10-6-4-5-7-11(10)15(3)13-12/h4-7H,8-9H2,1-3H3
InChIKey
RQTFJYVDXHOMPF-UHFFFAOYSA-N
Compound name
N,N-dimethyl-2-(1-methylindazol-3-yl)oxyethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

219.13716 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.14444 148.7
[M+Na]+ 242.12638 158.3
[M-H]- 218.12988 152.6
[M+NH4]+ 237.17098 168.3
[M+K]+ 258.10032 156.4
[M+H-H2O]+ 202.13442 140.7
[M+HCOO]- 264.13536 173.5
[M+CH3COO]- 278.15101 195.4
[M+Na-2H]- 240.11183 155.2
[M]+ 219.13661 154.5
[M]- 219.13771 154.5
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

patents stripe