CID 22407280

4-(tetrahydrofuran-2-yl)butan-1-amine

Structural Information

Molecular Formula
C8H17NO
SMILES
C1CC(OC1)CCCCN
InChI
InChI=1S/C8H17NO/c9-6-2-1-4-8-5-3-7-10-8/h8H,1-7,9H2
InChIKey
WZXMXJLBCUNKJB-UHFFFAOYSA-N
Compound name
4-(oxolan-2-yl)butan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
Patents

143.13101 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.13829 133.3
[M+Na]+ 166.12023 138.1
[M-H]- 142.12373 136.1
[M+NH4]+ 161.16483 154.5
[M+K]+ 182.09417 138.0
[M+H-H2O]+ 126.12827 127.7
[M+HCOO]- 188.12921 155.6
[M+CH3COO]- 202.14486 175.2
[M+Na-2H]- 164.10568 138.0
[M]+ 143.13046 130.9
[M]- 143.13156 130.9
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