CID 66404493

[(1-ethyl-1h-pyrrol-3-yl)methyl](methyl)amine hydrochloride

Structural Information

Molecular Formula
C8H14N2
SMILES
CCN1C=CC(=C1)CNC
InChI
InChI=1S/C8H14N2/c1-3-10-5-4-8(7-10)6-9-2/h4-5,7,9H,3,6H2,1-2H3
InChIKey
PAQTZJCQRHONNN-UHFFFAOYSA-N
Compound name
1-(1-ethylpyrrol-3-yl)-N-methylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

138.11569 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 139.12297 129.4
[M+Na]+ 161.10491 137.2
[M-H]- 137.10841 131.8
[M+NH4]+ 156.14951 151.6
[M+K]+ 177.07885 135.7
[M+H-H2O]+ 121.11295 123.0
[M+HCOO]- 183.11389 154.7
[M+CH3COO]- 197.12954 177.0
[M+Na-2H]- 159.09036 135.5
[M]+ 138.11514 129.8
[M]- 138.11624 129.8
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.