CID 200268

1h-indazole, 3-(3-(dimethylamino)propoxy)-1-methyl-, monohydrochloride

Structural Information

Molecular Formula
C13H19N3O
SMILES
CN1C2=CC=CC=C2C(=N1)OCCCN(C)C
InChI
InChI=1S/C13H19N3O/c1-15(2)9-6-10-17-13-11-7-4-5-8-12(11)16(3)14-13/h4-5,7-8H,6,9-10H2,1-3H3
InChIKey
BNTROCZJDQYZQO-UHFFFAOYSA-N
Compound name
N,N-dimethyl-3-(1-methylindazol-3-yl)oxypropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

233.15282 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.16010 152.8
[M+Na]+ 256.14204 165.6
[M+NH4]+ 251.18664 161.0
[M+K]+ 272.11598 160.5
[M-H]- 232.14554 155.0
[M+Na-2H]- 254.12749 159.2
[M]+ 233.15227 155.2
[M]- 233.15337 155.2
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