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]+ 129.138626 129.1
[M+Na]+ 151.120568 136.2
[M-H]- 127.124074 130.8
[M+NH4]+ 146.165173 151.6
[M+K]+ 167.094508 135.1
[M+H-H2O]+ 111.128610 123.3
[M+HCOO]- 173.129551 151.2
[M+CH3COO]- 187.145201 175.1
[M+Na-2H]- 149.106016 131.9
[M]+ 128.13080142 125.5
[M]- 128.13189858 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