CID 13742285

933760-06-6

Structural Information

Molecular Formula
C9H18N2O
SMILES
C1COCC1CN2CCNCC2
InChI
InChI=1S/C9H18N2O/c1-6-12-8-9(1)7-11-4-2-10-3-5-11/h9-10H,1-8H2
InChIKey
BSWVSDVQRSJADG-UHFFFAOYSA-N
Compound name
1-(oxolan-3-ylmethyl)piperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

34
Patents

170.1419 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.149176 140.1
[M+Na]+ 193.131118 143.1
[M-H]- 169.134624 141.5
[M+NH4]+ 188.175723 156.7
[M+K]+ 209.105058 142.2
[M+H-H2O]+ 153.139160 132.0
[M+HCOO]- 215.140101 154.7
[M+CH3COO]- 229.155751 150.5
[M+Na-2H]- 191.116566 143.1
[M]+ 170.14135142 132.1
[M]- 170.14244858 132.1
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