CID 21978903

[1-(propan-2-yl)pyrrolidin-3-yl]methanamine

Structural Information

Molecular Formula
C8H18N2
SMILES
CC(C)N1CCC(C1)CN
InChI
InChI=1S/C8H18N2/c1-7(2)10-4-3-8(5-9)6-10/h7-8H,3-6,9H2,1-2H3
InChIKey
DJCJZTOPDLHBRF-UHFFFAOYSA-N
Compound name
(1-propan-2-ylpyrrolidin-3-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

93
Patents

142.147 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.15428 134.7
[M+Na]+ 165.13622 140.2
[M-H]- 141.13972 135.9
[M+NH4]+ 160.18082 156.2
[M+K]+ 181.11016 139.2
[M+H-H2O]+ 125.14426 128.4
[M+HCOO]- 187.14520 155.4
[M+CH3COO]- 201.16085 177.9
[M+Na-2H]- 163.12167 136.3
[M]+ 142.14645 130.4
[M]- 142.14755 130.4
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