CID 82074887

2-cyclopropyl-3-phenylpropan-1-amine hydrochloride

Structural Information

Molecular Formula
C12H17N
SMILES
C1CC1C(CC2=CC=CC=C2)CN
InChI
InChI=1S/C12H17N/c13-9-12(11-6-7-11)8-10-4-2-1-3-5-10/h1-5,11-12H,6-9,13H2
InChIKey
VHPKDXJFGDKQKV-UHFFFAOYSA-N
Compound name
2-cyclopropyl-3-phenylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

175.1361 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.14338 135.8
[M+Na]+ 198.12532 142.8
[M-H]- 174.12882 142.5
[M+NH4]+ 193.16992 150.6
[M+K]+ 214.09926 139.6
[M+H-H2O]+ 158.13336 129.0
[M+HCOO]- 220.13430 159.6
[M+CH3COO]- 234.14995 187.1
[M+Na-2H]- 196.11077 141.5
[M]+ 175.13555 135.7
[M]- 175.13665 135.7
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

No patent data available for this compound.