CID 18712666

4-ethyl-1-methylpyrrolidin-3-amine

Structural Information

Molecular Formula
C7H16N2
SMILES
CCC1CN(CC1N)C
InChI
InChI=1S/C7H16N2/c1-3-6-4-9(2)5-7(6)8/h6-7H,3-5,8H2,1-2H3
InChIKey
BUMPPBOTOYSNPL-UHFFFAOYSA-N
Compound name
4-ethyl-1-methylpyrrolidin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

128.13135 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.13863 129.1
[M+Na]+ 151.12057 136.2
[M-H]- 127.12407 130.8
[M+NH4]+ 146.16517 151.6
[M+K]+ 167.09451 135.1
[M+H-H2O]+ 111.12861 123.3
[M+HCOO]- 173.12955 151.2
[M+CH3COO]- 187.14520 175.1
[M+Na-2H]- 149.10602 131.9
[M]+ 128.13080 125.5
[M]- 128.13190 125.5
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