CID 13437354

2-(1h-pyrrol-3-yl)ethan-1-amine hydrochloride

Structural Information

Molecular Formula
C6H10N2
SMILES
C1=CNC=C1CCN
InChI
InChI=1S/C6H10N2/c7-3-1-6-2-4-8-5-6/h2,4-5,8H,1,3,7H2
InChIKey
ZBJSHMBQYSDTGK-UHFFFAOYSA-N
Compound name
2-(1H-pyrrol-3-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

70
Patents

110.0844 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 111.09168 121.5
[M+Na]+ 133.07362 131.6
[M+NH4]+ 128.11822 130.0
[M+K]+ 149.04756 127.7
[M-H]- 109.07712 122.7
[M+Na-2H]- 131.05907 127.3
[M]+ 110.08385 123.0
[M]- 110.08495 123.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

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