CID 82593782

2-(oxolan-3-yl)propan-1-amine

Structural Information

Molecular Formula
C7H15NO
SMILES
CC(CN)C1CCOC1
InChI
InChI=1S/C7H15NO/c1-6(4-8)7-2-3-9-5-7/h6-7H,2-5,8H2,1H3
InChIKey
YKZZZCIUOWXQBI-UHFFFAOYSA-N
Compound name
2-(oxolan-3-yl)propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

129.11537 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.122646 129.8
[M+Na]+ 152.104588 134.7
[M-H]- 128.108094 132.9
[M+NH4]+ 147.149193 151.5
[M+K]+ 168.078528 135.4
[M+H-H2O]+ 112.112630 124.4
[M+HCOO]- 174.113571 151.4
[M+CH3COO]- 188.129221 173.0
[M+Na-2H]- 150.090036 133.7
[M]+ 129.11482142 126.3
[M]- 129.11591858 126.3
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