CID 82490438

(1-cyclopropyl-2,5-dimethyl-1h-pyrrol-3-yl)methanamine

Structural Information

Molecular Formula
C10H16N2
SMILES
CC1=CC(=C(N1C2CC2)C)CN
InChI
InChI=1S/C10H16N2/c1-7-5-9(6-11)8(2)12(7)10-3-4-10/h5,10H,3-4,6,11H2,1-2H3
InChIKey
MEGOBROMTMGWEV-UHFFFAOYSA-N
Compound name
(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

164.13135 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.13863 135.2
[M+Na]+ 187.12057 146.0
[M-H]- 163.12407 141.7
[M+NH4]+ 182.16517 151.8
[M+K]+ 203.09451 141.9
[M+H-H2O]+ 147.12861 128.8
[M+HCOO]- 209.12955 159.6
[M+CH3COO]- 223.14520 186.3
[M+Na-2H]- 185.10602 138.5
[M]+ 164.13080 137.3
[M]- 164.13190 137.3
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.