CID 63558631

3-(2-aminopropoxy)oxolane

Structural Information

Molecular Formula
C7H15NO2
SMILES
CC(COC1CCOC1)N
InChI
InChI=1S/C7H15NO2/c1-6(8)4-10-7-2-3-9-5-7/h6-7H,2-5,8H2,1H3
InChIKey
XYMTXWOHZOBDGQ-UHFFFAOYSA-N
Compound name
1-(oxolan-3-yloxy)propan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

145.11028 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.117556 132.6
[M+Na]+ 168.099498 137.4
[M-H]- 144.103004 135.6
[M+NH4]+ 163.144103 153.5
[M+K]+ 184.073438 138.5
[M+H-H2O]+ 128.107540 127.0
[M+HCOO]- 190.108481 154.4
[M+CH3COO]- 204.124131 175.1
[M+Na-2H]- 166.084946 136.5
[M]+ 145.10973142 130.5
[M]- 145.11082858 130.5
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.