CID 94557846

2287237-14-1

Structural Information

Molecular Formula
C13H17N
SMILES
C1CC2=CC=CC=C2[C@]3(C1)C[C@H]3CN
InChI
InChI=1S/C13H17N/c14-9-11-8-13(11)7-3-5-10-4-1-2-6-12(10)13/h1-2,4,6,11H,3,5,7-9,14H2/t11-,13+/m0/s1
InChIKey
VMSMCNSSOIREHC-WCQYABFASA-N
Compound name
[(1'R,4R)-spiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-yl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

187.1361 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.14338 143.0
[M+Na]+ 210.12532 157.1
[M+NH4]+ 205.16992 155.6
[M+K]+ 226.09926 148.7
[M-H]- 186.12882 155.0
[M+Na-2H]- 208.11077 153.9
[M]+ 187.13555 149.8
[M]- 187.13665 149.8
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.