CID 53414699

3-(azetidin-1-yl)pyrrolidine dihydrochloride

Structural Information

Molecular Formula
C7H14N2
SMILES
C1CN(C1)C2CCNC2
InChI
InChI=1S/C7H14N2/c1-4-9(5-1)7-2-3-8-6-7/h7-8H,1-6H2
InChIKey
FHIICFSXQPELBP-UHFFFAOYSA-N
Compound name
3-(azetidin-1-yl)pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

32
Patents

126.1157 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 127.12298 123.9
[M+Na]+ 149.10492 128.0
[M-H]- 125.10842 125.7
[M+NH4]+ 144.14952 137.7
[M+K]+ 165.07886 129.4
[M+H-H2O]+ 109.11296 112.1
[M+HCOO]- 171.11390 141.3
[M+CH3COO]- 185.12955 170.9
[M+Na-2H]- 147.09037 128.0
[M]+ 126.11515 126.1
[M]- 126.11625 126.1
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