CID 260796

Dimethyl[(1h-pyrrol-2-yl)methyl]amine

Structural Information

Molecular Formula
C7H12N2
SMILES
CN(C)CC1=CC=CN1
InChI
InChI=1S/C7H12N2/c1-9(2)6-7-4-3-5-8-7/h3-5,8H,6H2,1-2H3
InChIKey
BJIDGKXFJLYGNA-UHFFFAOYSA-N
Compound name
N,N-dimethyl-1-(1H-pyrrol-2-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

118
Patents

124.10005 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 125.10733 125.9
[M+Na]+ 147.08927 132.9
[M-H]- 123.09277 128.2
[M+NH4]+ 142.13387 148.3
[M+K]+ 163.06321 132.2
[M+H-H2O]+ 107.09731 119.5
[M+HCOO]- 169.09825 150.6
[M+CH3COO]- 183.11390 173.7
[M+Na-2H]- 145.07472 131.9
[M]+ 124.09950 124.9
[M]- 124.10060 124.9
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

patents stripe