CID 67140611

(1r,2s)-2,6-dimethyl-2,3-dihydro-1h-inden-1-amine

Structural Information

Molecular Formula
C11H15N
SMILES
C[C@H]1CC2=C([C@@H]1N)C=C(C=C2)C
InChI
InChI=1S/C11H15N/c1-7-3-4-9-6-8(2)11(12)10(9)5-7/h3-5,8,11H,6,12H2,1-2H3/t8-,11+/m0/s1
InChIKey
NMRCYNVWDPJOAC-GZMMTYOYSA-N
Compound name
(1R,2S)-2,6-dimethyl-2,3-dihydro-1H-inden-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

117
Patents

161.12045 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.127726 134.4
[M+Na]+ 184.109668 143.4
[M-H]- 160.113174 139.1
[M+NH4]+ 179.154273 158.4
[M+K]+ 200.083608 140.1
[M+H-H2O]+ 144.117710 129.5
[M+HCOO]- 206.118651 158.0
[M+CH3COO]- 220.134301 182.6
[M+Na-2H]- 182.095116 138.6
[M]+ 161.11990142 132.6
[M]- 161.12099858 132.6
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