CID 57444437

3,3-dicyclopropylpropan-1-amine

Structural Information

Molecular Formula
C9H17N
SMILES
C1CC1C(CCN)C2CC2
InChI
InChI=1S/C9H17N/c10-6-5-9(7-1-2-7)8-3-4-8/h7-9H,1-6,10H2
InChIKey
WLGMERNHAYRSNO-UHFFFAOYSA-N
Compound name
3,3-dicyclopropylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

139.1361 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.14338 136.7
[M+Na]+ 162.12532 142.7
[M-H]- 138.12882 143.3
[M+NH4]+ 157.16992 146.4
[M+K]+ 178.09926 141.2
[M+H-H2O]+ 122.13336 130.7
[M+HCOO]- 184.13430 157.0
[M+CH3COO]- 198.14995 191.3
[M+Na-2H]- 160.11077 139.9
[M]+ 139.13555 138.2
[M]- 139.13665 138.2
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