CID 57652763

882188-78-5

Structural Information

Molecular Formula
C11H15N
SMILES
CC1([C@@H]([C@H]1N)C2=CC=CC=C2)C
InChI
InChI=1S/C11H15N/c1-11(2)9(10(11)12)8-6-4-3-5-7-8/h3-7,9-10H,12H2,1-2H3/t9-,10-/m1/s1
InChIKey
NFISWOCMUKKIGN-NXEZZACHSA-N
Compound name
cis-(1R,3S)-2,2-dimethyl-3-phenylcyclopropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

161.12045 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.127726 131.9
[M+Na]+ 184.109668 142.2
[M-H]- 160.113174 139.9
[M+NH4]+ 179.154273 149.9
[M+K]+ 200.083608 139.6
[M+H-H2O]+ 144.117710 126.8
[M+HCOO]- 206.118651 156.6
[M+CH3COO]- 220.134301 185.1
[M+Na-2H]- 182.095116 138.9
[M]+ 161.11990142 133.3
[M]- 161.12099858 133.3
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