CID 22170041

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

Structural Information

Molecular Formula
C7H15NO
SMILES
C1CC(OC1)CCCN
InChI
InChI=1S/C7H15NO/c8-5-1-3-7-4-2-6-9-7/h7H,1-6,8H2
InChIKey
RVTMIVWSLUDRBP-UHFFFAOYSA-N
Compound name
3-(oxolan-2-yl)propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

129.11537 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.12265 128.7
[M+Na]+ 152.10459 133.8
[M-H]- 128.10809 131.6
[M+NH4]+ 147.14919 150.4
[M+K]+ 168.07853 134.1
[M+H-H2O]+ 112.11263 123.2
[M+HCOO]- 174.11357 151.3
[M+CH3COO]- 188.12922 172.2
[M+Na-2H]- 150.09004 133.9
[M]+ 129.11482 125.8
[M]- 129.11592 125.8
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