CID 54593878

4-(cyclopropylamino)butan-1-ol

Structural Information

Molecular Formula
C7H15NO
SMILES
C1CC1NCCCCO
InChI
InChI=1S/C7H15NO/c9-6-2-1-5-8-7-3-4-7/h7-9H,1-6H2
InChIKey
SGVSGIKGXAFXQZ-UHFFFAOYSA-N
Compound name
4-(cyclopropylamino)butan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
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 126.5
[M+Na]+ 152.10459 137.2
[M+NH4]+ 147.14919 135.3
[M+K]+ 168.07853 133.1
[M-H]- 128.10809 134.5
[M+Na-2H]- 150.09004 134.0
[M]+ 129.11482 131.1
[M]- 129.11592 131.1
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