CID 2737195

682802-92-2

Structural Information

Molecular Formula
C8H16N2O2
SMILES
C1CN(CCN1)CC2OCCO2
InChI
InChI=1S/C8H16N2O2/c1-3-10(4-2-9-1)7-8-11-5-6-12-8/h8-9H,1-7H2
InChIKey
SVNRBBGYRRYAMG-UHFFFAOYSA-N
Compound name
1-(1,3-dioxolan-2-ylmethyl)piperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

41
Patents

172.12119 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.128466 138.6
[M+Na]+ 195.110408 142.1
[M-H]- 171.113914 140.8
[M+NH4]+ 190.155013 153.7
[M+K]+ 211.084348 142.7
[M+H-H2O]+ 155.118450 130.8
[M+HCOO]- 217.119391 152.8
[M+CH3COO]- 231.135041 149.4
[M+Na-2H]- 193.095856 142.9
[M]+ 172.12064142 132.3
[M]- 172.12173858 132.3
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