CID 130163950

1867569-04-7

Structural Information

Molecular Formula
C8H16N2
SMILES
C1C[C@@H](NC1)CN2CCC2
InChI
InChI=1S/C8H16N2/c1-3-8(9-4-1)7-10-5-2-6-10/h8-9H,1-7H2/t8-/m1/s1
InChIKey
AFZWQLQILTTXHG-MRVPVSSYSA-N
Compound name
(2R)-2-(azetidin-1-ylmethyl)pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

140.13135 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.138626 128.5
[M+Na]+ 163.120568 132.2
[M-H]- 139.124074 130.1
[M+NH4]+ 158.165173 141.7
[M+K]+ 179.094508 133.2
[M+H-H2O]+ 123.128610 116.4
[M+HCOO]- 185.129551 145.5
[M+CH3COO]- 199.145201 173.9
[M+Na-2H]- 161.106016 132.0
[M]+ 140.13080142 131.0
[M]- 140.13189858 131.0
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