CID 13313617

1-[(oxiran-2-yl)methyl]pyrrolidine

Structural Information

Molecular Formula
C7H13NO
SMILES
C1CCN(C1)CC2CO2
InChI
InChI=1S/C7H13NO/c1-2-4-8(3-1)5-7-6-9-7/h7H,1-6H2
InChIKey
WRGDZAIBNCGSKR-UHFFFAOYSA-N
Compound name
1-(oxiran-2-ylmethyl)pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

127.09972 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.10700 128.0
[M+Na]+ 150.08894 136.2
[M-H]- 126.09244 134.3
[M+NH4]+ 145.13354 144.1
[M+K]+ 166.06288 135.9
[M+H-H2O]+ 110.09698 121.0
[M+HCOO]- 172.09792 149.1
[M+CH3COO]- 186.11357 173.1
[M+Na-2H]- 148.07439 134.0
[M]+ 127.09917 128.6
[M]- 127.10027 128.6
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