CID 130625301

159822-94-3

Structural Information

Molecular Formula
C10H17N
SMILES
CC(=C)[C@H]1CCC(=CC1)CN
InChI
InChI=1S/C10H17N/c1-8(2)10-5-3-9(7-11)4-6-10/h3,10H,1,4-7,11H2,2H3/t10-/m1/s1
InChIKey
LEFDFSDZBGZSER-SNVBAGLBSA-N
Compound name
[(4S)-4-prop-1-en-2-ylcyclohexen-1-yl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

151.1361 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.14338 135.5
[M+Na]+ 174.12532 140.5
[M-H]- 150.12882 138.0
[M+NH4]+ 169.16992 156.2
[M+K]+ 190.09926 138.3
[M+H-H2O]+ 134.13336 129.9
[M+HCOO]- 196.13430 156.4
[M+CH3COO]- 210.14995 180.3
[M+Na-2H]- 172.11077 138.4
[M]+ 151.13555 130.1
[M]- 151.13665 130.1
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

No patent data available for this compound.