CID 15028164

(1-ethylpyrrolidin-3-yl)methanamine

Structural Information

Molecular Formula
C7H16N2
SMILES
CCN1CCC(C1)CN
InChI
InChI=1S/C7H16N2/c1-2-9-4-3-7(5-8)6-9/h7H,2-6,8H2,1H3
InChIKey
NKJWMNYRBVKMJY-UHFFFAOYSA-N
Compound name
(1-ethylpyrrolidin-3-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

119
Patents

128.13135 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.13863 129.4
[M+Na]+ 151.12057 135.5
[M-H]- 127.12407 130.6
[M+NH4]+ 146.16517 151.5
[M+K]+ 167.09451 134.4
[M+H-H2O]+ 111.12861 123.1
[M+HCOO]- 173.12955 151.4
[M+CH3COO]- 187.14520 174.0
[M+Na-2H]- 149.10602 132.8
[M]+ 128.13080 125.4
[M]- 128.13190 125.4
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