CID 6424797

1-methyl-2-[(1-methyl-1h-pyrrol-2-yl)methyl]-1h-pyrrole

Structural Information

Molecular Formula
C11H14N2
SMILES
CN1C=CC=C1CC2=CC=CN2C
InChI
InChI=1S/C11H14N2/c1-12-7-3-5-10(12)9-11-6-4-8-13(11)2/h3-8H,9H2,1-2H3
InChIKey
GIRSHINZLWWKIV-UHFFFAOYSA-N
Compound name
1-methyl-2-[(1-methylpyrrol-2-yl)methyl]pyrrole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

174.11569 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.12297 136.1
[M+Na]+ 197.10491 146.8
[M-H]- 173.10841 141.3
[M+NH4]+ 192.14951 157.8
[M+K]+ 213.07885 144.0
[M+H-H2O]+ 157.11295 128.8
[M+HCOO]- 219.11389 161.9
[M+CH3COO]- 233.12954 151.0
[M+Na-2H]- 195.09036 140.2
[M]+ 174.11514 139.1
[M]- 174.11624 139.1
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