CID 62116815

3-cyclobutoxypropan-1-amine

Structural Information

Molecular Formula
C7H15NO
SMILES
C1CC(C1)OCCCN
InChI
InChI=1S/C7H15NO/c8-5-2-6-9-7-3-1-4-7/h7H,1-6,8H2
InChIKey
MTKDNOYEYHKXJO-UHFFFAOYSA-N
Compound name
3-cyclobutyloxypropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

129.11537 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.122646 127.0
[M+Na]+ 152.104588 131.2
[M-H]- 128.108094 129.6
[M+NH4]+ 147.149193 141.9
[M+K]+ 168.078528 133.8
[M+H-H2O]+ 112.112630 116.3
[M+HCOO]- 174.113571 149.3
[M+CH3COO]- 188.129221 177.8
[M+Na-2H]- 150.090036 132.5
[M]+ 129.11482142 134.0
[M]- 129.11591858 134.0
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