CID 131500243

3-(azetidin-1-yl)-3-methylpyrrolidine

Structural Information

Molecular Formula
C8H16N2
SMILES
CC1(CCNC1)N2CCC2
InChI
InChI=1S/C8H16N2/c1-8(3-4-9-7-8)10-5-2-6-10/h9H,2-7H2,1H3
InChIKey
MQCJPQPHJZXNRB-UHFFFAOYSA-N
Compound name
3-(azetidin-1-yl)-3-methylpyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

140.13135 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.13863 130.2
[M+Na]+ 163.12057 134.8
[M-H]- 139.12407 132.2
[M+NH4]+ 158.16517 145.4
[M+K]+ 179.09451 135.8
[M+H-H2O]+ 123.12861 119.2
[M+HCOO]- 185.12955 147.2
[M+CH3COO]- 199.14520 173.4
[M+Na-2H]- 161.10602 134.6
[M]+ 140.13080 132.9
[M]- 140.13190 132.9
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

No patent data available for this compound.